SCHEMBL7240384

SCHEMBL7240384

COc1ccc(COc2cc(F)cc(Br)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.53
APP P05067 7/20 0.51
FFAR1 O14842 1/20 0.46
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
POLB P06746 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL310367 0.89 MAOB (0.60) MAOBAPPFFAR1NPC1RAB9A
SCHEMBL14895605 0.89 MAOB (0.60) MAOBAPPFFAR1NPC1RAB9A
SCHEMBL7803831 0.84 TUBB1 (0.47) MAOBFFAR1SMN1; SMN2
SCHEMBL2226602 0.82 MAOB (0.62) MAOBFFAR1RAB9ASMN1; SMN2
SCHEMBL7240044 0.81 MAOB (0.53) MAOBAPPFFAR1NPC1RAB9A
SCHEMBL3930569 0.81 APP (0.63) MAOBAPPNPC1RAB9APOLB
SCHEMBL17205237 0.81 MAOB (0.49) MAOBAPPNPC1RAB9APOLB
SCHEMBL1195442 0.81 MAOB (0.49) MAOBAPPFFAR1NPC1RAB9A
SCHEMBL28413184 0.80 RAB9A (0.54) MAOBNPC1RAB9ASMN1; SMN2
SCHEMBL309260 0.79 MAOB (0.50) MAOBAPPFFAR1NPC1RAB9A

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
US-6552018-B1 As antitumor agents DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-04-22 US disclosed
US-6169086-B1 AN ANTITUMOR AGENT FOR TREATING TUMOR RESISTANT TO 5-FLUOROURACIL TYPE DRUGS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2001-01-02 US disclosed
EP-1022270-A1 PYRAZOLE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2000-07-26 EP disclosed