SCHEMBL11770754

SCHEMBL11770754

O=C(O)c1ccc(C(O)c2ccc(C(O)c3ccc(C(=O)O)c(C(=O)O)c3)cc2)cc1C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 6/20 0.60
▸ TDP1 Q9NUW8 5/20 0.60
▸ MEN1 O00255 3/20 0.60
▸ CYP2C9 P11712 3/20 0.60
▸ KMT2A Q03164 3/20 0.60
▸ CYP2C19 P33261 2/20 0.60
▸ CYP2D6 P10635 1/20 0.60
▸ GRM8 O00222 1/20 0.60
▸ GRM6 O15303 1/20 0.60
▸ SLC6A2 P23975 1/20 0.60
▸ SLC6A4 P31645 1/20 0.60
▸ DRD3 P35462 1/20 0.60
▸ GRM4 Q14833 1/20 0.60
▸ ALDH1A1 P00352 7/20 0.47
▸ KDM4E B2RXH2 4/20 0.47
▸ HPGD P15428 4/20 0.47
▸ GRM1 Q13255 3/20 0.47
▸ GRM2 Q14416 2/20 0.43
▸ RXRA P19793 1/20 0.42
▸ CDC25A P30304 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
SCHEMBL1955154 0.98 HSD17B10 (0.62) HSD17B10TDP1MEN1CYP2C9KMT2A
SCHEMBL11770761 0.84 HSD17B10 (0.53) HSD17B10TDP1MEN1CYP2C9KMT2A
SCHEMBL19886217 0.84 HSD17B10 (0.49) HSD17B10TDP1MEN1CYP2C9KMT2A
SCHEMBL9269600 0.82 HSD17B10 (0.47) HSD17B10TDP1MEN1CYP2C9KMT2A
SCHEMBL8908076 0.81 HSD17B10 (0.46) HSD17B10TDP1MEN1CYP2C9KMT2A
SCHEMBL9269604 0.81 HSD17B10 (0.46) HSD17B10TDP1MEN1CYP2C9KMT2A
SCHEMBL9853831 0.81 HSD17B10 (0.58) HSD17B10TDP1MEN1CYP2C9KMT2A
SCHEMBL25017789 0.80 KDM4E (0.59) HSD17B10TDP1MEN1CYP2C9KMT2A
SCHEMBL1356399 0.78 HSD17B10 (0.60) HSD17B10TDP1MEN1CYP2C9KMT2A
SCHEMBL29401129 0.78 HSD17B10 (0.60) HSD17B10TDP1MEN1CYP2C9KMT2A

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
US-3933745-A Imide copolymers possessing hydroxyl groups RHONE-POULENC S.A. (FR) 1976-01-20 — — US disclosed
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