SCHEMBL9756802

SCHEMBL9756802

CC(=O)OCc1ccc(C=CC(=O)O)o1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.48
L3MBTL1 Q9Y468 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
KMT2A Q03164 2/20 0.48
ALDH1A1 P00352 8/20 0.44
MAPT P10636 4/20 0.44
KDM4E B2RXH2 4/20 0.44
PKM P14618 1/20 0.44
HTT P42858 1/20 0.44
HSD17B10 Q99714 1/20 0.42
MEN1 O00255 1/20 0.41
RARA P10276 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP1B1 Q16678 1/20 0.40
HCAR2 Q8TDS4 1/20 0.39
HDAC1 Q13547 5/20 0.39
HDAC3 O15379 4/20 0.38
HDAC4 P56524 4/20 0.38
HDAC7 Q8WUI4 4/20 0.38

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
SCHEMBL28383522 1.00 POLB (0.48) POLBL3MBTL1TDP1KMT2AALDH1A1
SCHEMBL17537559 0.84 POLB (0.49) POLBL3MBTL1TDP1KMT2AALDH1A1
SCHEMBL51038 0.81 ALDH1A1 (0.55) POLBL3MBTL1TDP1KMT2AALDH1A1
SCHEMBL16205894 0.80 ALDH1A1 (0.47) POLBL3MBTL1TDP1KMT2AALDH1A1
SCHEMBL8824515 0.79 CYP1A2 (0.58) POLBL3MBTL1TDP1KMT2AALDH1A1
SCHEMBL8824516 0.79 CYP1A2 (0.58) POLBL3MBTL1TDP1KMT2AALDH1A1
SCHEMBL2541634 0.78 ALDH1A1 (0.60) POLBL3MBTL1TDP1KMT2AALDH1A1
SCHEMBL3202919 0.77 ALDH1A1 (0.58) POLBL3MBTL1TDP1KMT2AALDH1A1
SCHEMBL3202914 0.77 ALDH1A1 (0.58) POLBL3MBTL1TDP1KMT2AALDH1A1
SCHEMBL19220828 0.77 ALDH1A1 (0.45) POLBTDP1KMT2AALDH1A1MAPT

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
US-5039684-A Absorption when administered orally VALEAS S. P. A. (IT) 1991-08-13 US disclosed
EP-0384450-A1 Tetrazole amide derivatives of heterocyclic alkenyl acids and their use as antiallergic substances VALEAS S.p.A. INDUSTRIA CHIMICA E FARMACEUTICA (IT) 1990-08-29 EP disclosed