SCHEMBL1925255

SCHEMBL1925255

O=C(O)c1ccccc1C1CCCCC1c1ccccc1C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.52
ALOX15 P16050 1/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
CYP2C9 P11712 1/20 0.50
KDM4E B2RXH2 1/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
HMGB1 P09429 1/20 0.45
HPGD P15428 1/20 0.45
CA4 P22748 1/20 0.45
CA6 P23280 1/20 0.45
CA7 P43166 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CA9 Q16790 1/20 0.45
NAPRT Q6XQN6 1/20 0.45
CA14 Q9ULX7 1/20 0.45
MAPT P10636 2/20 0.44
LMNA P02545 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
SCHEMBL3691542 0.87 CYP2C9 (0.44) ALDH1A1ALOX15MEN1KMT2ACYP2C9
SCHEMBL2731512 0.86 ALDH1A1 (0.50) ALDH1A1ALOX15CYP2C9KDM4ECA12
SCHEMBL50486 0.84 PTGDR2 (0.53) ALDH1A1ALOX15CYP2C9ABCC1ACMSD
SCHEMBL30730923 0.84 PTGDR2 (0.53) ALDH1A1ALOX15CYP2C9ABCC1ACMSD
Bicarbonate SCHEMBL11642792 0.84 PTGDR2 (0.49) ALDH1A1ALOX15CYP2C9KDM4ECA12
Ammonia Solution, Strong SCHEMBL29036685 0.82 PTGDR2 (0.51) ALDH1A1ALOX15CYP2C9ABCC1ACMSD
SCHEMBL3634253 0.82 ALDH1A1 (0.50) ALDH1A1ALOX15CYP2C9KDM4ECA12
SCHEMBL28029683 0.81 ALDH1A1 (0.45) ALDH1A1ALOX15CYP2C9KDM4ECA12
SCHEMBL4109572 0.81 ALDH1A1 (0.54) ALDH1A1ALOX15CYP2C9KDM4ECA12
SCHEMBL10457353 0.81 ALDH1A1 (0.54) ALDH1A1ALOX15CYP2C9KDM4ECA12

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-8729189-B2 Propylene-based block copolymer, composition containing the copolymer, and molded products obtained therefrom MITSUI CHEMICALS, INC. (JP) 2014-05-20 US disclosed
US-20110172353-A1 PROPYLENE-BASED BLOCK COPOLYMER, COMPOSITION CONTAINING THE COPOLYMER, AND MOLDED PRODUCTS OBTAINED THEREFROM MITSUI CHEMICALS, INC. (JP) 2011-07-14 US disclosed
EP-2330139-A1 PROPYLENE-BASED BLOCK COPOLYMER AND COMPOSITION CONTAINING SAID COPOLYMER, AND MOLDED BODY OBTAINED THEREFROM Mitsui Chemicals, Inc. (JP) 2011-06-08 EP disclosed