SCHEMBL8375731

SCHEMBL8375731

COc1ccc(-c2cc(O)no2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.64
MAPT P10636 3/20 0.64
ALDH1A1 P00352 1/20 0.64
RECQL P46063 1/20 0.64
RAB9A P51151 13/20 0.59
NPC1 O15118 12/20 0.59
SMN1; SMN2 Q16637 5/20 0.56
TP53 P04637 3/20 0.56
HSD17B10 Q99714 2/20 0.51
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
HDAC3 O15379 1/20 0.50
HDAC4 P56524 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC11 Q96DB2 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50

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
SCHEMBL8380033 0.81 ALDH1A1 (0.67) HPGDMAPTALDH1A1RAB9ANPC1
SCHEMBL8376624 0.81 CDH1 (0.54) HPGDMAPTALDH1A1RECQLRAB9A
SCHEMBL18031151 0.80 NPC1 (0.75) HPGDMAPTALDH1A1RECQLRAB9A
SCHEMBL10647488 0.80 CYP1A2 (0.64) HPGDMAPTALDH1A1RECQLRAB9A
SCHEMBL1181029 0.80 NPC1 (0.87) HPGDMAPTALDH1A1RECQLRAB9A
SCHEMBL2959768 0.79 NPC1 (0.56) HPGDMAPTALDH1A1RAB9ANPC1
SCHEMBL8375802 0.79 ALDH1A1 (0.61) HPGDMAPTALDH1A1RAB9ANPC1
SCHEMBL4104544 0.79 RAB9A (0.59) HPGDMAPTALDH1A1RECQLRAB9A
SCHEMBL892240 0.78 HPGD (1.00) HPGDMAPTALDH1A1RECQLRAB9A
SCHEMBL8196656 0.78 NOTUM (0.64) HPGDMAPTALDH1A1RECQLRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6005116-A HAVE INHIBITION ACTIVITIES AGAINST TYPE A-MONOAMINE OXIDASE; TREATING OR PREVENTING DEPRESSION, PARKINSON'S DISEASE, ALZEHEIMER'S DEMENTIA, OR CEREBROVASCULAR DEMENTIA SANKYO COMPANY, LIMITED (JP) 1999-12-21 US disclosed
EP-0885891-A1 ISOXAZOLE DERIVATIVES SANKYO COMPANY LIMITED (JP) 1998-12-23 EP disclosed
US-5221750-A Chemical intermediate for positive working compound in silver halide emulsion photographic material FUJI PHOTO FILM CO., LTD. (JP) 1993-06-22 US disclosed
US-4950764-A HERBICIDES, BACTERICIDES, ANALGESICS, ANTIINFLAMMATORY AGENT FUJI PHOTO FILM CO., LTD. (JP) 1990-08-21 US disclosed