SCHEMBL27465432

SCHEMBL27465432

Cc1nc2ccc(C(=O)N(CCC[C@@H](C)O)[SH](=O)=O)cc2n1Cc1ccc(Cl)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 2/20 0.53
▸ MC4R P32245 10/20 0.39
▸ LMNA P02545 2/20 0.37
▸ VDR P11473 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ HDAC3 O15379 2/20 0.35
▸ HDAC4 P56524 2/20 0.35
▸ HDAC1 Q13547 2/20 0.35
▸ HDAC7 Q8WUI4 2/20 0.35
▸ HDAC2 Q92769 2/20 0.35
▸ HDAC10 Q969S8 2/20 0.35
▸ HDAC11 Q96DB2 2/20 0.35
▸ HDAC8 Q9BY41 2/20 0.35
▸ HDAC6 Q9UBN7 2/20 0.35

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
SCHEMBL27450180 1.00 PPARG (0.53) PPARGMC4RLMNAVDRMEN1
SCHEMBL27449185 0.88 PPARG (0.53) PPARGMC4RLMNAVDRMEN1
SCHEMBL27450620 0.85 PPARG (0.55) PPARGMC4RLMNAVDRMEN1
SCHEMBL27524156 0.81 PPARG (0.47) PPARGMC4RALOX5APMC5RMC3R
SCHEMBL27450178 0.80 PPARG (0.53) PPARGMC4RHDAC3HDAC4HDAC1
SCHEMBL27449649 0.80 PPARG (0.48) PPARGMC4RMC5RMC3RMC1R
SCHEMBL7656058 0.79 PPARG (0.80) PPARGLMNAMEN1KMT2AHDAC3
SCHEMBL27465431 0.79 PPARG (0.52) PPARGMC4RHDAC3HDAC4HDAC1
SCHEMBL7648867 0.79 PPARG (0.80) PPARGLMNAMEN1KMT2AHDAC3
SCHEMBL7648861 0.79 PPARG (0.80) PPARGLMNAMEN1KMT2AHDAC3

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
CN-1135224-C Benzimidazole derivatives ����ҩƷ��ҵ��ʽ���� 2004-01-21 — — CN disclosed
CN-1268123-A Benzimidazole derivatives FUJISAWA PHARMACEUTICAL CO (JP) 2000-09-27 — — CN disclosed
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