SCHEMBL147461

SCHEMBL147461

CC(=O)Oc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](OC(C)=O)CC[C@@H]12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 1.00
SMN1; SMN2 Q16637 5/20 1.00
CYP3A4 P08684 4/20 1.00
TP53 P04637 3/20 1.00
ESR1 P03372 7/20 0.85
LMNA P02545 7/20 0.79
KMT2A Q03164 6/20 0.79
MEN1 O00255 4/20 0.79
ALOX15 P16050 3/20 0.79
MAPK1 P28482 2/20 0.79
BRCA1 P38398 1/20 0.79
RECQL P46063 1/20 0.79
ADORA3 P0DMS8 5/20 0.78
ATM Q13315 3/20 0.78
PGR P06401 3/20 0.78
AR P10275 3/20 0.78
CHRM1 P11229 2/20 0.78
TBXA2R P21731 2/20 0.78
ADRA1A P35348 1/20 0.78
OPRM1 P35372 1/20 0.78

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
SCHEMBL14094308 1.00 MAPT (1.00) MAPTSMN1; SMN2CYP3A4TP53ESR1
SCHEMBL29616163 1.00 MAPT (1.00) MAPTSMN1; SMN2CYP3A4TP53ESR1
SCHEMBL17302844 1.00 MAPT (1.00) MAPTSMN1; SMN2CYP3A4TP53ESR1
SCHEMBL29351015 1.00 MAPT (1.00) MAPTSMN1; SMN2CYP3A4TP53ESR1
SCHEMBL12449418 0.92 ESR1 (1.00) MAPTSMN1; SMN2CYP3A4TP53ESR1
SCHEMBL2232043 0.92 ESR1 (1.00) MAPTSMN1; SMN2CYP3A4TP53ESR1
SCHEMBL5033759 0.91 MAPT (0.82) MAPTSMN1; SMN2CYP3A4TP53ESR1
SCHEMBL3299315 0.90 MAPT (0.81) MAPTSMN1; SMN2CYP3A4TP53ESR1
SCHEMBL8155723 0.90 MAPT (0.81) MAPTSMN1; SMN2CYP3A4TP53ESR1
SCHEMBL20885240 0.89 SMN1; SMN2 (0.80) MAPTSMN1; SMN2CYP3A4TP53ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3993856-A1 AEROSOL DELIVERY DEVICES AND METHODS OF USING SAME Airja, Inc. (US) 2022-05-11 EP claimed
WO-2021003438-A1 AEROSOL DELIVERY DEVICES AND METHODS OF USING SAME AIRJA, INC. (US) 2021-01-07 WO claimed
US-9782419-B2 Transdermal contraceptive hormones delivery AGILE THERAPEUTICS, INC. (US) 2017-10-10 US claimed
US-9775817-B2 Transdermal contraceptive hormones delivery AGILE THERAPEUTICS, INC. (US) 2017-10-03 US claimed
US-9775847-B2 Transdermal contraceptive hormones delivery AGILE THERAPEUTICS, INC. (US) 2017-10-03 US claimed
US-9775848-B2 Transdermal contraceptive hormones delivery AGILE THERAPEUTICS, INC. (US) 2017-10-03 US claimed
US-20170087099-A1 TRANSDERMAL SYSTEMS CONTAINING MULTILAYER ADHESIVE MATRICES TO MODIFY DRUG DELIVERY MYLAN TECH INC (US) 2017-03-30 US claimed
EP-2608829-A2 SYSTEMS AND METHODS OF AEROSOL DELIVERY WITH AIRFLOW REGULATION Rubin, Darren (US) 2013-07-03 EP claimed
WO-2012026963-A2 SYSTEMS AND METHODS OF AEROSOL DELIVERY WITH AIRFLOW REGULATION RUBIN DARREN (US) 2012-03-01 WO claimed
US-20070287688-A1 Pharmaceutical Compositions for Topical Application MACRO CHEM CORPORATION 2007-12-13 US claimed
WO-2007092085-A2 FRAGRANCED THERAPEUTIC DELIVERY SYSTEM MURAD HOWARD (US) 2007-08-16 WO claimed
EP-1809240-A2 CARDIAC SAFE, RAPID MEDICATION DELIVERY Alexza Pharmaceuticals, Inc. (US) 2007-07-25 EP claimed
US-7090830-B2 Drug condensation aerosols and kits ALEXZA PHARMACEUTICALS, INC. (US) 2006-08-15 US claimed
US-20060120962-A1 Cardiac safe, rapid medication delivery NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2006-06-08 US claimed
WO-2006044421-A2 CARDIAC SAFE, RAPID MEDICATION DELIVERY ALEXZA PHARMACEUTICALS, INC. (US) 2006-04-27 WO claimed
EP-1648364-A2 PHARMACEUTICAL COMPOSITIONS FOR TOPICAL APPLICATION MacroChem Corporation (US) 2006-04-26 EP claimed
WO-2005007100-A2 PHARMACEUTICAL COMPOSITIONS FOR TOPICAL APPLICATION MACROCHEM CORPORATION (US) 2005-01-27 WO claimed
US-20040099269-A1 Drug condensation aerosols and kits ALEXZA MOLECULAR DELIVERY CORPORATION (US) 2004-05-27 US claimed
EP-0269696-B1 TRANSDERMAL ABSORPTION DOSAGE UNIT FOR ESTRADIOL AND OTHER ESTROGENIC STEROIDS UNIV RUTGERS (US) 1994-08-03 EP claimed
US-4346709-A Drug delivery devices comprising erodible polymer and erosion rate modifier ALZA CORPORATION (US) 1982-08-31 US 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 (1 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-20070287688-A1 Pharmaceutical Compositions for Topical Application CYP8B1, NR1H3, NR1H2 MAPT 3668/4885SMN1; SMN2 3027/4885CYP3A4 174/4885

“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.