SCHEMBL27778044

SCHEMBL27778044

CC(=O)CCc1cccc(N(F)C(C)=O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.51
▸ CRHBP P24387 1/20 0.43
▸ CRHR2 Q13324 1/20 0.43
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ MAOA P21397 1/20 0.41
▸ SLC6A2 P23975 1/20 0.41
▸ SLC6A3 Q01959 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ GAA P10253 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ THRA P10827 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ IAPP P10997 1/20 0.38

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
SCHEMBL10783421 0.84 CRHBP (0.56) ALDH1A1CRHBPCRHR2NPC1RAB9A
SCHEMBL7322435 0.82 ALDH1A1 (0.56) ALDH1A1CRHBPCRHR2NPC1RAB9A
SCHEMBL27641824 0.81 CRHBP (0.45) ALDH1A1CRHBPCRHR2KDM4ECYP1A2
SCHEMBL27757187 0.80 ALDH1A1 (0.53) ALDH1A1NPC1RAB9AKDM4ELMNA
SCHEMBL18768957 0.79 ALDH1A1 (0.72) ALDH1A1NPC1RAB9AKDM4ELMNA
SCHEMBL2290 0.78 ALDH1A1 (0.60) ALDH1A1NPC1RAB9AKDM4ELMNA
SCHEMBL27641818 0.74 CES2 (0.45) ALDH1A1CRHBPCRHR2NPC1RAB9A
SCHEMBL4593938 0.73 ALDH1A1 (0.49) ALDH1A1NPC1RAB9AMAPTSLC6A3
SCHEMBL27831317 0.73 ALDH1A1 (0.53) ALDH1A1CRHBPCRHR2KDM4ELMNA
SCHEMBL2027905 0.73 ALDH1A1 (0.62) ALDH1A1NPC1RAB9AKDM4ELMNA

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
CN-101535315-A Heterocyclic compounds useful as anabolic agents for livestock animals PFIZER LTD (GB) 2009-09-16 — — CN disclosed
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