SCHEMBL604997

SCHEMBL604997

C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@H]43)[C@@H]1CC[C@@H]2OC(=O)C1CCCCC1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.65
▸ LMNA P02545 3/20 0.65
▸ ALDH1A1 P00352 3/20 0.62
▸ SERPINA6 P08185 2/20 0.62
▸ SHBG P04278 2/20 0.62
▸ SLC22A1 O15245 1/20 0.62
▸ THRB P10828 1/20 0.62
▸ HIF1A Q16665 2/20 0.59
▸ MCL1 Q07820 1/20 0.59
▸ CYP1A2 P05177 1/20 0.59
▸ HSD17B10 Q99714 1/20 0.59
▸ CYP19A1 P11511 2/20 0.51
▸ PGR P06401 3/20 0.49
▸ ABCB11 O95342 3/20 0.49
▸ CYP3A4 P08684 3/20 0.49
▸ NR3C1 P04150 2/20 0.49
▸ CYP2C19 P33261 2/20 0.49
▸ CHRM2 P08172 1/20 0.49
▸ ADORA3 P0DMS8 1/20 0.49
▸ AR P10275 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11595349 1.00 MAPT (0.65) MAPTLMNAALDH1A1SERPINA6SHBG
SCHEMBL13804528 0.86 MAPT (0.71) MAPTLMNAALDH1A1SERPINA6SHBG
SCHEMBL17302789 0.86 MAPT (0.71) MAPTLMNAALDH1A1SERPINA6SHBG
SCHEMBL13177160 0.86 MAPT (0.71) MAPTLMNAALDH1A1SERPINA6SHBG
SCHEMBL2930366 0.86 MAPT (0.71) MAPTLMNAALDH1A1SERPINA6SHBG
SCHEMBL3458086 0.86 MAPT (0.71) MAPTLMNAALDH1A1SERPINA6SHBG
Cyclohexane SCHEMBL8027519 0.86 MAPT (0.76) MAPTLMNAALDH1A1SERPINA6SHBG
SCHEMBL24103254 0.85 MAPT (0.69) MAPTLMNAALDH1A1SERPINA6SHBG
SCHEMBL9473555 0.85 MAPT (0.69) MAPTLMNAALDH1A1SERPINA6SHBG
SCHEMBL24103304 0.85 MAPT (0.69) MAPTLMNAALDH1A1SERPINA6SHBG

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 561 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9616072-B2 Reduction of side effects from aromatase inhibitors used for treating breast cancer CHAVAH PTY LTD. (AU) 2017-04-11 — — US claimed
US-20160129015-A1 Reduction of Side Effects from Aromatase Inhibitors Used for Treating Breast Cancer Havah Therapeutics Pty Ltd. (AU) 2016-05-12 — — US claimed
US-20150320739-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II BAUSCH HEALTH IRELAND LIMITED (F/K/A/ VALEANT PHARMACEUTICALS IRELAND LIMITED) (IE) 2015-11-12 — — US claimed
US-20130203766-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II SPROUT PHARMACEUTICALS, INC. (US) 2013-08-08 — — US claimed
US-20120122824-A1 Reduction of Side Effects From Aromatase Inhibitors Used for Treating Breast Cancer CHAVAH PTY LTD (AU) 2012-05-17 — — US claimed
EP-1945224-B1 REDUCTION OF SIDE EFFECTS FROM AROMATASE INHIBITORS USED FOR TREATING BREAST CANCER CHAVAH PTY LTD (AU) 2012-05-02 — — EP claimed
US-20110195114-A1 TRANSDERMAL DELIVERY SYSTEMS FOR ACTIVE AGENTS ANTARES PHARMA, IPL, AG 2011-08-11 — — US claimed
US-20110105519-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II SPROUT PHARMACEUTICALS, INC. 2011-05-05 — — US claimed
US-20090215731-A1 Reduction of Side Effects From Aromatase Inhibitors Used for Treating Breast Cancer CHAVAH PTY LTD. (AU) 2009-08-27 — — US claimed
EP-1945224-A1 REDUCTION OF SIDE EFFECTS FROM AROMATASE INHIBITORS USED FOR TREATING BREAST CANCER Chavah Pty Ltd (AU) 2008-07-23 — — EP claimed
WO-2002051420-A2 METHODS AND FORMULATIONS FOR THE TREATMENT OF FEMALE SEXUAL DYSFUNCTION ENDEAVOR PHARMACEUTICALS (US) 2002-07-04 — — WO claimed
EP-1150629-A1 DRUG DOSAGE UNIT FOR BUCCAL ADMINISTRATION OF STEROIDAL ACTIVE AGENTS Place, Virgil A. (US) 2001-11-07 — — EP claimed
US-20010036483-A1 Transdermal administration of androgenic drugs using hydroxide-releasing agents as permeation enhancers TECHNOLOGY RECOVERY SYSTEMS, LLC 2001-11-01 — — US claimed
US-6284263-B1 Buccal drug administration in the treatment of female sexual dysfunction PLACE VIRGIL A (US) 2001-09-04 — — US claimed
US-6241529-B1 AFFIXING DOSAGE UNIT COMPRISED OF A COMPRESSED TABLET OF A BIOERODIBLE POLYMERIC CARRIER AND ANDROGENIC AGENT, PROGESTIN, AND ESTROGEN TO BUCCAL MUCOSA; USEFUL FOR FEMALE HORMONE REPLACEMENT THERAPY, CONTRACEPTION, AND SEXUAL DYSFUNCTION Place, Virgil A. 2001-06-05 — — US claimed
US-6221379-B1 BUCCAL DOSAGE UNIT COMPRISED OF A COMPRESSED TABLET OF A BIOERODIBLE POLYMERIC CARRIER AND AN ANDROGENIC AGENT; A PROGESTIN AND AN ESTROGEN; AND AFFIXING THE DOSAGE UNIT TO THE BUCCAL MUCOSA OF THE INDIVIDUAL Place, Virgil A. 2001-04-24 — — US claimed
US-6180682-B1 COMPRESSION TABLET IN POLYMERIC CARRIER Place, Virgil A. 2001-01-30 — — US claimed
US-6117446-A A BUCCAL DOSAGE UNIT FOR ADMINISTERING A COMBINATION OF STEROIDAL ACTIVE AGENTS, COMPRISING A COMPRESSED TABLET OF A BIOERODIBLE POLYMERIC CARRIER AND AN ANDROGENIC AGENT SELECTED FROM TESTOSTERONE AND ESTERS, PROGESTIN AND ESTEROGEN PLACE, VIRGIL A. 2000-09-12 — — US claimed
WO-2000042955-A1 DRUG DOSAGE UNIT FOR BUCCAL ADMINISTRATION OF STEROIDAL ACTIVE AGENTS PLACE VIRGIL A (US) 2000-07-27 — — WO claimed
WO-2000042942-A2 BUCCAL DRUG DELIVERY SYSTEM FOR USE IN MALE CONTRACEPTION PLACE VIRGIL A (US) 2000-07-27 — — WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130203766-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II FLNB, FLNA, FGB MAPT 3020/4885LMNA 1578/4885ALDH1A1 948/4885
US-20110105519-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II FLNB, FLNA, FGB MAPT 3020/4885LMNA 1578/4885ALDH1A1 948/4885
US-20150320739-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II FLNB, FLNA, FGB MAPT 3020/4885LMNA 1578/4885ALDH1A1 948/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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