SCHEMBL14435240

SCHEMBL14435240

C[C@@H](CN1CCCC1)Oc1cc(Cl)ccc1C1CCN(C(=O)[C@H](N)Cc2ccc(Cl)cc2F)CC1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ADAM17 P78536 2/20 0.42
▸ ADAMTS5 Q9UNA0 2/20 0.42
▸ MC4R P32245 9/20 0.40
▸ HPGD P15428 1/20 0.38
▸ HDAC8 Q9BY41 5/20 0.38
▸ HDAC3 O15379 1/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ HDAC2 Q92769 1/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.38
▸ USP2 O75604 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ MC5R P33032 1/20 0.36
▸ MC3R P41968 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
SCHEMBL14435242 1.00 ADAM17 (0.42) ADAM17ADAMTS5MC4RHPGDHDAC8
SCHEMBL14436417 0.92 HDAC8 (0.47) ADAM17ADAMTS5MC4RHPGDHDAC8
SCHEMBL14435273 0.91 ADAM17 (0.39) ADAM17ADAMTS5MC4RHDAC8HDAC3
SCHEMBL12713270 0.86 HTR7 (0.39) ADAM17ADAMTS5MC4RHDAC8HDAC3
SCHEMBL14435238 0.84 ADAM17 (0.43) ADAM17ADAMTS5MC4RHDAC8HDAC3
SCHEMBL14435248 0.84 ADAM17 (0.43) ADAM17ADAMTS5MC4RHDAC8HDAC3
SCHEMBL14435280 0.83 MC4R (0.41) MC4RHDAC8HDAC3HDAC1HDAC2
SCHEMBL14435264 0.83 ADAM17 (0.40) ADAM17ADAMTS5MC4RHDAC8HDAC3
SCHEMBL14435253 0.83 ADAM17 (0.40) ADAM17ADAMTS5MC4RHDAC8HDAC3
SCHEMBL14435251 0.81 ADAM17 (0.39) ADAM17ADAMTS5MC4RHDAC8HDAC3

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-2007096186-A1 SUBSTITUTED PHENYLPIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR MODULATORS SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2007-08-30 — — WO disclosed
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