SCHEMBL10360466

SCHEMBL10360466

CCOCCCOC(C)C

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.38
▸ LMNA P02545 1/20 0.35
▸ TSHR P16473 2/20 0.34
▸ THRB P10828 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL4430835 0.97 ALDH1A1 (0.36) ALDH1A1LMNATSHR
SCHEMBL10147816 0.92 ALDH1A1 (0.36) ALDH1A1LMNATSHRTHRB
SCHEMBL4436545 0.90 ALDH1A1 (0.35) ALDH1A1LMNATSHRTHRB
SCHEMBL8356913 0.86 CYP3A4 (0.40) ALDH1A1TSHR
SCHEMBL26739892 0.86 ALDH1A1 (0.38) ALDH1A1LMNATSHRSMN1; SMN2
SCHEMBL2757538 0.83 — —
SCHEMBL2735121 0.83 ALDH1A1 (0.41) ALDH1A1LMNATSHRSMN1; SMN2
SCHEMBL17640888 0.82 TSHR (0.48) TSHRTHRBHPGDSMN1; SMN2
SCHEMBL25840274 0.82 HSD17B10 (0.41) ALDH1A1TSHRTHRB
SCHEMBL4830580 0.81 ALDH1A1 (0.39) ALDH1A1LMNATSHRTHRB

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11661410-B2 Tricyclic compounds as histone methyltransferase inhibitors GLOBAL BLOOD THERAPEUTICS, INC. (US) 2023-05-30 — — US disclosed
US-20230136194-A1 TRIAZOLOPYRIDAZINE DERIVATIVE, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF Shanghai Simr Biotechnology Co., Ltd. (CN) 2023-05-04 — — US disclosed
US-20170342068-A1 COMPOUNDS FOR THE TREATMENT OF HEPATITIS B VIRUS INFECTION GILEAD SCIENCES, INC. 2017-11-30 — — US disclosed
US-20120184541-A1 COMPOUNDS AND METHODS OF USE ABBVIE INC. 2012-07-19 — — US disclosed
US-8003680-B2 Therapeutic compounds ALLERGAN, INC. (US) 2011-08-23 — — US disclosed
US-20100048669-A1 THERAPEUTIC COMPOUNDS ALLERGAN, INC. (US) 2010-02-25 — — US disclosed
US-7592366-B2 Therapeutic compounds ALLERGAN, INC. (US) 2009-09-22 — — US disclosed
US-20090181932-A1 COMPOSITIONS CONTAINING O-SULFATE AND O-PHOSPHATE CONTAINING ARYL SULFONAMIDE DERIVATIVES USEFUL AS beta-AMYLOID INHIBITORS WYETH (US) 2009-07-16 — — US disclosed
US-7507833-B2 Therapeutic N-aryl or N-heteroaryl pyrazolidine and pyrazolidinone derivatives ALLERGAN, INC. (US) 2009-03-24 — — US disclosed
US-20080045576-A1 THERAPEUTIC N-ARYL OR N-HETEROARYL PYRAZOLIDINE AND PYRAZOLIDINONE DERIVATIVES ALLERGAN, INC. 2008-02-21 — — US disclosed
US-20080015231-A1 THERAPEUTIC COMPOUNDS ALLERGAN, INC. 2008-01-17 — — US disclosed
US-7226950-B2 Sodium channel modulators THERAVANCE, INC. (US) 2007-06-05 — — US disclosed

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

For each of this compound's patents that has machine-readable text (8 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-20230136194-A1 TRIAZOLOPYRIDAZINE DERIVATIVE, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF ABCG2, CYP4F8, CYP3A5 ALDH1A1 440/4885LMNA 3800/4885TSHR 2486/4885
US-11661410-B2 Tricyclic compounds as histone methyltransferase inhibitors EHMT1, EHMT2, BMI1 ALDH1A1 1652/4885LMNA 344/4885TSHR 3593/4885
US-20080045576-A1 THERAPEUTIC N-ARYL OR N-HETEROARYL PYRAZOLIDINE AND PYRAZOLIDINONE DERIVATIVES GOT2, GOT1, NME4 ALDH1A1 1555/4885LMNA 935/4885TSHR 1819/4885
US-20100048669-A1 THERAPEUTIC COMPOUNDS GOT2, ANXA5, GOT1 ALDH1A1 553/4885LMNA 1806/4885TSHR 4020/4885
US-20090181932-A1 COMPOSITIONS CONTAINING O-SULFATE AND O-PHOSPHATE CONTAINING ARYL SULFONAMIDE DERIVATIVES USEFUL AS beta-AMYLOID INHIBITORS SCN3A, HCN3, KCNN3 ALDH1A1 3777/4885LMNA 1386/4885TSHR 2853/4885
US-20080015231-A1 THERAPEUTIC COMPOUNDS GOT2, ANXA5, COXFA4L2 ALDH1A1 438/4885LMNA 2115/4885TSHR 4392/4885
US-20120184541-A1 COMPOUNDS AND METHODS OF USE BCL2A1, BCL2, BAX ALDH1A1 3814/4885LMNA 316/4885TSHR 1965/4885
US-20170342068-A1 COMPOUNDS FOR THE TREATMENT OF HEPATITIS B VIRUS INFECTION HAVCR2, PYGL, OAT ALDH1A1 695/4885LMNA 2667/4885TSHR 3818/4885

“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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