SCHEMBL11676747

SCHEMBL11676747

CCC(CN(CC)c1ccccc1)Oc1cccc(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 2/20 0.42
▸ GHSR Q92847 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.39
▸ KMT2A Q03164 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ OGG1 O15527 1/20 0.37
▸ SLC6A2 P23975 1/20 0.36
▸ SLC6A3 Q01959 1/20 0.36

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
SCHEMBL11677239 0.86 TSHR (0.44) KMT2AALDH1A1MAPT
SCHEMBL11676749 0.85 MAPT (0.43) MAPT
SCHEMBL11676210 0.85 PPARG (0.41) SLC6A4KMT2AMAPT
SCHEMBL11670393 0.85 KMT2A (0.43) GHSRKDM4EKMT2AMAPT
SCHEMBL11675539 0.81 TSHR (0.43) SLC6A4KMT2AALDH1A1MAPTSLC6A2
SCHEMBL11676994 0.81 NOS2 (0.45) SLC6A4KDM4EKMT2AALDH1A1MAPT
SCHEMBL11676946 0.80 TSHR (0.37) SLC6A4KMT2AMAPT
SCHEMBL11671695 0.80 KMT2A (0.43) GHSRKDM4EKMT2AALDH1A1MAPT
SCHEMBL11677032 0.80 ADRA2A (0.42) SLC6A4KDM4EKMT2AALDH1A1MAPT
SCHEMBL11677645 0.78 CNR2 (0.44) SLC6A4KDM4EKMT2AALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4051084-A BENZOTHIAZOLE BAYER AKTIENGESELLSCHAFT (DT) 1977-09-27 — — US disclosed
US-4051117-A Triazole-azo-phenyl cationic dyestuffs BAYER AKTIENGESELLSCHAFT (DT) 1977-09-27 — — US disclosed
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