SCHEMBL29699699

SCHEMBL29699699

CC(C)(O)c1ccccc1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.54
ALOX15 P16050 3/20 0.54
CA12 O43570 3/20 0.46
CA1 P00915 3/20 0.46
CA2 P00918 3/20 0.46
CA4 P22748 3/20 0.46
CA7 P43166 3/20 0.46
CA9 Q16790 3/20 0.46
KDM4E B2RXH2 2/20 0.46
HMGB1 P09429 2/20 0.46
HPGD P15428 2/20 0.46
NAPRT Q6XQN6 2/20 0.46
CA6 P23280 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CA14 Q9ULX7 1/20 0.46
MAPT P10636 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
LMNA P02545 1/20 0.44
AKR1C3 P42330 2/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL4850365 1.00 ALDH1A1 (0.54) ALDH1A1ALOX15CA12CA1CA2
SCHEMBL8879432 0.98 ALDH1A1 (0.52) ALDH1A1ALOX15CA12CA1CA2
SCHEMBL9120488 0.87 ALDH1A1 (0.54) ALDH1A1ALOX15CA12CA1CA2
SCHEMBL2214094 0.84 ALDH1A1 (0.56) ALDH1A1ALOX15CA12CA1CA2
SCHEMBL31028133 0.84 ALDH1A1 (0.56) ALDH1A1ALOX15CA12CA1CA2
SCHEMBL6858557 0.84 ELANE (0.46) ALDH1A1ALOX15SMN1; SMN2MAPTLMNA
SCHEMBL39249 0.84 ALDH1A1 (0.56) ALDH1A1ALOX15CA12CA1CA2
SCHEMBL8878983 0.83 ALDH1A1 (0.57) ALDH1A1ALOX15CA12CA1CA2
SCHEMBL27957440 0.83 ALDH1A1 (0.50) ALDH1A1ALOX15CA12CA1CA2
SCHEMBL4575902 0.83 PDK2 (0.45) ALDH1A1ALOX15KDM4ESMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110018540-B Stretched film and method for producing same 柯尼卡美能达株式会社 2022-06-14 CN disclosed