SCHEMBL4368758

SCHEMBL4368758

Cc1c(OC(=O)NC2CCCCC2)cc(-c2cc(C(F)(F)F)ccc2Cl)n1C[C@H]1CCCO1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.51
TSHR P16473 1/20 0.41
CNR2 P34972 4/20 0.40
CRHR1 P34998 5/20 0.39
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ADRB2 P07550 1/20 0.38
FAAH O00519 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.37
RORC P51449 1/20 0.37

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
SCHEMBL4375499 0.92 CNR1 (0.49) CNR1TSHRCNR2CRHR1FAAH
SCHEMBL4368598 0.91 CNR2 (0.42) CNR1TSHRCNR2
SCHEMBL4374742 0.91 TSHR (0.42) CNR1TSHRCNR2ALDH1A1LMNA
SCHEMBL4380007 0.90 CNR1 (0.60) CNR1TSHRCNR2CRHR1KDM4E
SCHEMBL4380450 0.89 CNR1 (0.43) CNR1TSHRCNR2CRHR1ALDH1A1
SCHEMBL4369770 0.88 CNR1 (0.48) CNR1CRHR1FAAHMRGPRX4
SCHEMBL4371325 0.86 CNR1 (0.65) CNR1CNR2CRHR1FAAH
SCHEMBL4373433 0.85 ALDH1A1 (0.40) TSHRCNR2ALDH1A1LMNASMN1; SMN2
SCHEMBL4373566 0.83 CNR1 (0.58) CNR1TSHRCNR2CRHR1
SCHEMBL4376045 0.83 TSHR (0.42) CNR1TSHRCNR2ALDH1A1KDM4E

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
EP-1749002-B1 PYRROLE OR IMIDAZOLE AMIDES FOR TREATING OBESITY HOFFMANN LA ROCHE (CH) 2009-05-27 EP claimed