SCHEMBL9495997

SCHEMBL9495997

O=C(O)c1ccccc1C/C=N/O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 2/20 0.50
ALDH1A1 P00352 5/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
TP53 P04637 1/20 0.41
HTT P42858 1/20 0.41
HMGB1 P09429 2/20 0.41
KDM4E B2RXH2 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
HPGD P15428 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA7 P43166 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CA9 Q16790 1/20 0.41
NAPRT Q6XQN6 1/20 0.41
CA14 Q9ULX7 1/20 0.41
HIF1A Q16665 2/20 0.41

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
SCHEMBL9496006 1.00 FOLH1 (0.50) FOLH1ALDH1A1ALOX15TSHRTP53
SCHEMBL11897138 0.80 FOLH1 (0.57) FOLH1ALDH1A1ALOX15TSHRTP53
SCHEMBL11897139 0.80 FOLH1 (0.57) FOLH1ALDH1A1ALOX15TSHRTP53
SCHEMBL11897168 0.80 FOLH1 (0.57) FOLH1ALDH1A1ALOX15TSHRTP53
SCHEMBL1074384 0.79 FOLH1 (0.55) FOLH1ALDH1A1ALOX15TSHRTP53
SCHEMBL89060 0.79 FOLH1 (0.55) FOLH1ALDH1A1ALOX15TSHRTP53
Benzene SCHEMBL27083018 0.79 FOLH1 (0.55) FOLH1ALDH1A1ALOX15TSHRTP53
Hydrochloric Acid SCHEMBL7974299 0.77 FOLH1 (0.53) FOLH1ALDH1A1ALOX15TSHRTP53
Potassium SCHEMBL16531822 0.77 FOLH1 (0.53) FOLH1ALDH1A1ALOX15TSHRTP53
SCHEMBL11094883 0.77 FOLH1 (0.53) FOLH1ALDH1A1ALOX15TSHRTP53

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-0240859-B1 LIPOXYGENASE INHIBITING COMPOUNDS ABBOTT LABORATORIES (US) 1993-04-28 EP disclosed
US-4761403-A QUINOLONE DERIVATIVES ABBOTT LABORATORIES (US) 1988-08-02 US disclosed
EP-0240859-A2 Lipoxygenase inhibiting compounds ABBOTT LABORATORIES (US) 1987-10-14 EP disclosed