SCHEMBL10453735

SCHEMBL10453735

CCOc1ccc2oc3cc(C(=O)OC)ccc3c(=O)c2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 8/20 0.50
▸ ALDH1A1 P00352 7/20 0.50
▸ HPGD P15428 6/20 0.50
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ TP53 P04637 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ PTGER1 P34995 1/20 0.50
▸ PTGER3 P43115 1/20 0.50
▸ PTGER2 P43116 1/20 0.50
▸ PTGDR Q13258 1/20 0.50
▸ NPC1 O15118 3/20 0.49
▸ RAB9A P51151 3/20 0.49
▸ MAPT P10636 2/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ CASP3 P42574 1/20 0.49
▸ SENP8 Q96LD8 1/20 0.49
▸ SENP7 Q9BQF6 1/20 0.49
▸ SENP6 Q9GZR1 1/20 0.49

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
SCHEMBL10452818 0.88 KDM4E (0.65) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL10452917 0.87 KDM4E (0.63) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL10454060 0.87 PARP10 (0.51) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL10452916 0.87 KDM4E (0.63) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL11319698 0.86 KDM4E (0.56) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL10452915 0.86 LTB4R (0.58) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL11865539 0.85 ALDH1A1 (0.55) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL3966330 0.83 CREBBP (0.56) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL11860605 0.83 KDM4E (0.72) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL11860960 0.81 KMT2A (0.50) KDM4EALDH1A1HPGDMEN1KMT2A

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-4902701-A Tetrazolyl substituted tricyclic compounds and pharmacological compositions thereof BURROUGHS WELCOME CO. (US) 1990-02-20 — — US disclosed
EP-0093381-B1 TRICYCLIC COMPOUNDS, PREPARATION, USE AND INTERMEDIATES THE WELLCOME FOUNDATION LIMITED (GB) 1986-07-23 — — EP disclosed
EP-0093381-A1 Tricyclic compounds, preparation, use and intermediates THE WELLCOME FOUNDATION LIMITED (GB) 1983-11-09 — — EP disclosed
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