SCHEMBL7319916

SCHEMBL7319916

O=C1C/C(=C\N2CCCCC2)Oc2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.45
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 5/20 0.40
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
GAA P10253 4/20 0.40
HPGD P15428 3/20 0.40
MAPT P10636 2/20 0.40
HTT P42858 1/20 0.40
ACHE P22303 2/20 0.37
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.36
NPSR1 Q6W5P4 2/20 0.36
CYP3A4 P08684 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
TSHR P16473 1/20 0.35
P2RX4 Q99571 1/20 0.35
SIGMAR1 Q99720 2/20 0.35
HSD17B10 Q99714 2/20 0.34

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
SCHEMBL7319921 1.00 ALDH1A1 (0.45) ALDH1A1LMNASMN1; SMN2NPC1RAB9A
SCHEMBL11813564 0.77 ALDH1A1 (0.40) ALDH1A1LMNASMN1; SMN2NPC1RAB9A
SCHEMBL28350913 0.74 STK17B (0.54) ALDH1A1HPGDACHEKMT2AMEN1
SCHEMBL2604370 0.70 MAOB (0.43) ALDH1A1LMNASMN1; SMN2NPC1RAB9A
SCHEMBL29366641 0.70 MAOB (0.43) ALDH1A1LMNASMN1; SMN2NPC1RAB9A
SCHEMBL11747245 0.70 ALDH1A1 (0.49) ALDH1A1LMNASMN1; SMN2HPGDMAPT
SCHEMBL11747241 0.70 ALDH1A1 (0.49) ALDH1A1LMNASMN1; SMN2HPGDMAPT
SCHEMBL3513736 0.69 TRPA1 (0.41) ALDH1A1LMNASMN1; SMN2RAB9AKMT2A
SCHEMBL10637852 0.69 APAF1 (0.49) ALDH1A1LMNASMN1; SMN2NPC1RAB9A
SCHEMBL8881096 0.68 LMNA (0.41) ALDH1A1LMNASMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5703075-A Antiatherosclerotic and antithrombotic 1-benzopyran-4-ones and 2-amino-1,3-benzoxazine-4-ones PHARMACIA & UPJOHN COMPANY (US) 1997-12-30 US disclosed
EP-0525123-B1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES UPJOHN CO (US) 1997-09-17 EP disclosed
WO-1991019707-A2 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES THE UPJOHN COMPANY (US) 1991-12-26 WO disclosed
EP-0459983-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES PHARMACIA & UPJOHN COMPANY (US) 1991-12-11 EP disclosed
WO-1990006921-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES THE UPJOHN COMPANY (US) 1990-06-28 WO disclosed