SCHEMBL29119412

SCHEMBL29119412

CCC(=C(C#N)C(=O)O)c1ccccc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.43
HPGD P15428 7/20 0.43
ALDH1A1 P00352 6/20 0.43
CA1 P00915 2/20 0.43
CA9 Q16790 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
CA12 O43570 1/20 0.43
CA2 P00918 1/20 0.43
HMGB1 P09429 1/20 0.43
CA4 P22748 1/20 0.43
CA6 P23280 1/20 0.43
CA7 P43166 1/20 0.43
NAPRT Q6XQN6 1/20 0.43
CA14 Q9ULX7 1/20 0.43
LMNA P02545 6/20 0.39
HSD17B10 Q99714 5/20 0.39
TSHR P16473 4/20 0.39
MAPT P10636 3/20 0.38
HTT P42858 2/20 0.38
TDP1 Q9NUW8 2/20 0.37

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
SCHEMBL29119427 0.86 ALDH1A1 (0.45) KDM4EHPGDALDH1A1CA1CA9
SCHEMBL19357468 0.80 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2LMNAMAPTXBP1
SCHEMBL19357469 0.80 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2LMNAMAPTXBP1
SCHEMBL29119392 0.79 HPGD (0.47) KDM4EHPGDALDH1A1CA1CA9
SCHEMBL8387504 0.76 KDM4E (0.47) KDM4EHPGDALDH1A1CA1CA9
SCHEMBL4541375 0.75 MEN1 (0.48) KDM4EHPGDALDH1A1CA1CA9
SCHEMBL4541373 0.75 MEN1 (0.48) KDM4EHPGDALDH1A1CA1CA9
SCHEMBL5074590 0.75 PBRM1 (0.50) ALDH1A1LMNAMAPTKMT2AMAPK1
SCHEMBL11049883 0.74 ESR1 (0.55) ALDH1A1SMN1; SMN2LMNAHSD17B10TSHR
SCHEMBL29119424 0.72 ALDH1A1 (0.44) ALDH1A1CA1CA9SMN1; SMN2CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117192672-A Resin film, method for producing resin film, and method for producing phase difference film 日东电工株式会社 2023-12-08 CN disclosed
CN-117192671-A Polarizing plate with phase difference layer 日东电工株式会社 2023-12-08 CN disclosed