SCHEMBL9909953

SCHEMBL9909953

CCn1nc(-c2cccs2)cc1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 11/20 0.51
▸ HSD17B10 Q99714 4/20 0.51
▸ TP53 P04637 3/20 0.51
▸ ADORA1 P30542 1/20 0.45
▸ KDM4E B2RXH2 7/20 0.43
▸ MEN1 O00255 7/20 0.43
▸ KMT2A Q03164 7/20 0.43
▸ MAPT P10636 4/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ NPC1 O15118 3/20 0.43
▸ RAB9A P51151 3/20 0.43
▸ CASP1 P29466 2/20 0.43
▸ HTT P42858 2/20 0.43
▸ CASP7 P55210 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ RAF1 P04049 1/20 0.43
▸ HSP90AA1 P07900 1/20 0.43
▸ HSP90AB1 P08238 1/20 0.43
▸ THRB P10828 1/20 0.43

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
SCHEMBL12601966 0.83 ADORA1 (0.44) ALDH1A1HSD17B10TP53ADORA1KDM4E
SCHEMBL820498 0.80 KDM4E (0.46) ALDH1A1HSD17B10TP53ADORA1KDM4E
SCHEMBL12090639 0.78 ALDH1A1 (0.51) ALDH1A1HSD17B10TP53KDM4EMEN1
SCHEMBL3064335 0.78 L3MBTL1 (0.56) ALDH1A1HSD17B10ADORA1KDM4EMEN1
SCHEMBL5292301 0.73 AURKA (0.48) ALDH1A1HSD17B10TP53KDM4EMEN1
SCHEMBL24656216 0.71 ADORA3 (0.45) ADORA1NPC1RAB9AHSP90AA1RECQL
SCHEMBL14035665 0.71 ALDH1A1 (0.45) ALDH1A1HSD17B10TP53ADORA1KDM4E
SCHEMBL2051509 0.70 KMT2A (0.47) ALDH1A1HSD17B10TP53ADORA1KDM4E
SCHEMBL595201 0.70 ALDH1A1 (0.57) ALDH1A1HSD17B10ADORA1KDM4EMEN1
SCHEMBL21398161 0.70 KDM4E (0.63) ALDH1A1HSD17B10TP53ADORA1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018102399-A1 METHODS OF DOSE ADMINISTRATION FOR TREATING OR PREVENTING COGNITIVE IMPAIRMENT USING INDANE ACETIC ACID DERIVATIVES T3D THERAPEUTICS, INC. (US) 2018-06-07 — — WO disclosed
US-20180153860-A1 METHODS OF DOSE ADMINISTRATION FOR TREATING OR PREVENTING COGNITIVE IMPAIRMENT USING INDANE ACETIC ACID DERIVATIVES T3D THERAPEUTICS, INC. (US) 2018-06-07 — — US disclosed
WO-2018102358-A1 METHODS OF TREATING OR PREVENTING COGNITIVE IMPAIRMENT USING INDANE ACETIC ACID DERIVATIVES BASED ON APOE4 GENOTYPE T3D THERAPEUTICS, INC. (US) 2018-06-07 — — WO disclosed
WO-2012074980-A2 METHODS OF TREATING OR PREVENTING AUTOIMMUNE DISORDERS AND LIVER DISORDERS USING INDANE ACETIC ACID DERIVATIVES DARA BIOSCIENCES, INC. (US) 2012-06-07 — — WO disclosed
WO-2010141696-A1 METHODS OF TREATING OR PREVENTING PSORIASIS, AND/OR ALZHEIMER'S DISEASE USING INDANE ACETIC ACID DERIVATIVES DARA BIOSCIENCES, INC. (US) 2010-12-09 — — WO disclosed
EP-1414809-B1 INDANE ACETIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICAL AGENTS, INTERMEDIATES, AND METHOD OF PREPARATION BAYER CORP (US) 2008-03-12 — — EP 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 (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-20180153860-A1 METHODS OF DOSE ADMINISTRATION FOR TREATING OR PREVENTING COGNITIVE IMPAIRMENT USING INDANE ACETIC ACID DERIVATIVES CHAT, ACHE, CHRNA2 ALDH1A1 118/4885HSD17B10 436/4885TP53 404/4885

“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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