SCHEMBL7422796

SCHEMBL7422796

COc1ccc(Br)c2cc(C(=O)C3CC3)oc12

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
F2RL3 Q96RI0 3/20 0.44
LMNA P02545 1/20 0.41
RECQL P46063 1/20 0.41
PDE4A P27815 8/20 0.41
PDE4B Q07343 8/20 0.41
PDE4C Q08493 8/20 0.41
PDE4D Q08499 8/20 0.41
CYP1A2 P05177 1/20 0.40
ALDH1A1 P00352 5/20 0.38
MAPT P10636 2/20 0.38
PKM P14618 1/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PIM1 P11309 1/20 0.37
KMT2A Q03164 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
SCHEMBL3610073 0.83 LMNA (0.57) F2RL3LMNARECQLPDE4APDE4B
SCHEMBL7423948 0.83 PDE4D (0.48) LMNARECQLPDE4APDE4BPDE4C
SCHEMBL16708177 0.78 F2RL3 (0.45) F2RL3LMNARECQLPDE4APDE4B
SCHEMBL16345218 0.76 LMNA (0.43) F2RL3LMNARECQLALDH1A1MAPT
SCHEMBL7427719 0.76 LMNA (0.68) LMNARECQLCYP1A2ALDH1A1MAPT
SCHEMBL7049405 0.74 PDE4A (0.59) F2RL3LMNARECQLPDE4APDE4B
SCHEMBL31482723 0.73 PDE4D (0.47) F2RL3PDE4BPDE4DCYP1A2ALDH1A1
SCHEMBL7425562 0.72 ALDH1A1 (0.43) LMNAPDE4APDE4BPDE4CPDE4D
SCHEMBL7053222 0.72 F2RL3 (0.42) F2RL3LMNARECQLPDE4APDE4B
SCHEMBL1368772 0.71 CA12 (0.47) F2RL3ALDH1A1MAPTHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1054884-A1 BENZOFURAN-4-CARBOXAMIDES AND THEIR THERAPEUTIC USE Darwin Discovery Limited (GB) 2000-11-29 EP disclosed
US-6066657-A Benzofuran-4-carboxamides and their therapeutic use DARWIN DISCOVERY, LTD. (GB) 2000-05-23 US disclosed
WO-1999040085-A1 BENZOFURAN-4-CARBOXAMIDES AND THEIR THERAPEUTIC USE DARWIN DISCOVERY LIMITED (GB) 1999-08-12 WO disclosed