SCHEMBL1503700

SCHEMBL1503700

C=C[CH]c1ccccc1C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.52
ALOX15 P16050 1/20 0.52
KDM4E B2RXH2 3/20 0.45
HPGD P15428 2/20 0.45
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA4 P22748 2/20 0.45
CA7 P43166 2/20 0.45
CA9 Q16790 2/20 0.45
HMGB1 P09429 1/20 0.45
CA6 P23280 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NAPRT Q6XQN6 1/20 0.45
CA14 Q9ULX7 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
MAPT P10636 3/20 0.43
HDAC8 Q9BY41 1/20 0.43
POLB P06746 1/20 0.42

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
Butadiene SCHEMBL11263308 0.88 ALDH1A1 (0.52) ALDH1A1ALOX15KDM4EHPGDCA12
Phthalic Acid SCHEMBL2316524 0.84 ALDH1A1 (0.74) ALDH1A1ALOX15KDM4EHPGDCA12
Benzene SCHEMBL28254104 0.83 ALDH1A1 (0.56) ALDH1A1ALOX15KDM4EHPGDCA12
SCHEMBL30259301 0.83 ALDH1A1 (0.56) ALDH1A1ALOX15KDM4EHPGDCA12
SCHEMBL31100 0.83 ALDH1A1 (0.56) ALDH1A1ALOX15KDM4EHPGDCA12
Styrene SCHEMBL28935148 0.81 ALDH1A1 (0.50) ALDH1A1ALOX15KDM4EHPGDCA12
Hydrochloric Acid SCHEMBL2909959 0.81 ALDH1A1 (0.54) ALDH1A1ALOX15KDM4EHPGDCA12
SCHEMBL347539 0.81 ALDH1A1 (0.54) ALDH1A1ALOX15KDM4EHPGDCA12
Ammonia Solution, Strong SCHEMBL6551345 0.81 ALDH1A1 (0.54) ALDH1A1ALOX15KDM4EHPGDCA12
SCHEMBL2867924 0.81 ALDH1A1 (0.54) ALDH1A1ALOX15KDM4EHPGDCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2011116939-A CURING AGENT FOR EPOXY RESIN NIPPON SYNTHETIC CHEM IND CO LTD:THE 2011-06-16 JP disclosed
WO-2011025040-A1 CURING AGENT FOR EPOXY RESINS 日本合成化学工業株式会社 (JP) 2011-03-03 WO disclosed
EP-0544819-B1 INDOLE DERIVATIVES WHICH INHIBIT LEUKOTRIENE BIOSYNTHESIS ABBOTT LAB (US) 1995-12-06 EP disclosed
US-5459150-A Treatment of allergies and inflammatory diseases ABBOTT LABORATORIES (US) 1995-10-17 US disclosed
EP-0544819-A4 INDOLE DERIVATIVES WHICH INHIBIT LEUKOTRIENE BIOSYNTHESIS 1993-10-20 EP disclosed
EP-0544819-A1 INDOLE DERIVATIVES WHICH INHIBIT LEUKOTRIENE BIOSYNTHESIS. ABBOTT LAB (US) 1993-06-09 EP disclosed
US-5095031-A Enzyme inhibitors, antiallergens, antiinflammatory ABBOTT LABORATORIES (US) 1992-03-10 US disclosed
WO-1992003132-A1 INDOLE DERIVATIVES WHICH INHIBIT LEUKOTRIENE BIOSYNTHESIS ABBOTT LABORATORIES (US) 1992-03-05 WO disclosed