SCHEMBL8305644

SCHEMBL8305644

CC1CCN(S(=O)(=O)c2ccc3nccc(C(=O)OCc4ccccc4F)c3c2)CC1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 2/20 0.50
▸ TSHR P16473 4/20 0.49
▸ HPGD P15428 2/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ MEN1 O00255 3/20 0.47
▸ MAPT P10636 4/20 0.46
▸ HTT P42858 1/20 0.46
▸ LMNA P02545 1/20 0.45
▸ THRB P10828 1/20 0.45
▸ RXFP1 Q9HBX9 2/20 0.45
▸ CYP2C9 P11712 1/20 0.44
▸ NPC1 O15118 1/20 0.43
▸ GLA P06280 1/20 0.43
▸ L3MBTL1 Q9Y468 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
SCHEMBL8308076 0.81 HPGD (0.55) USP2TSHRHPGDALDH1A1HSD17B10
SCHEMBL8303944 0.79 HTT (0.59) USP2TSHRHPGDALDH1A1HSD17B10
SCHEMBL8303721 0.78 KMT2A (0.50) USP2TSHRHPGDALDH1A1HSD17B10
SCHEMBL8305649 0.76 HTT (0.61) USP2TSHRALDH1A1KMT2AMEN1
SCHEMBL8308254 0.74 KMT2A (0.58) USP2TSHRHPGDALDH1A1HSD17B10
SCHEMBL8311179 0.72 KMT2A (0.47) USP2TSHRALDH1A1HSD17B10KMT2A
SCHEMBL8308077 0.71 KMT2A (0.52) USP2TSHRALDH1A1HSD17B10KMT2A
SCHEMBL8308788 0.70 USP2 (0.51) USP2TSHRHPGDALDH1A1HSD17B10
SCHEMBL8311188 0.69 KMT2A (0.74) TSHRALDH1A1KMT2AMAPTHTT
SCHEMBL8311182 0.68 RXFP1 (0.61) HPGDALDH1A1HSD17B10KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004078731-A1 QUINOLINE-CARBOXYLIC ACIDS AND THE DERIVATIVES THEREOF, A FOCUSED LIBRARY 'CHEMICAL DIVERSITY RESEARCH INSTITUTE', LTD. (RU) 2004-09-16 — — WO disclosed
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