SCHEMBL11538794

SCHEMBL11538794

CCc1ccc(COc2ccc(C(=O)O)[nH]c2=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 4/20 0.49
▸ RXRB P28702 3/20 0.49
▸ SRD5A2 P31213 2/20 0.42
▸ SRD5A1 P18405 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ RHEB Q15382 1/20 0.41
▸ RXRG P48443 2/20 0.40
▸ CSF1R P07333 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ CA12 O43570 1/20 0.40
▸ ALPL P05186 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ KDM5A P29375 1/20 0.39
▸ KDM2B Q8NHM5 1/20 0.39
▸ KDM4C Q9H3R0 1/20 0.39
▸ KDM5B Q9UGL1 1/20 0.39
▸ MRGPRX4 Q96LA9 2/20 0.39

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
SCHEMBL11531739 0.89 KDM4E (0.45) RXRARXRBSRD5A2SRD5A1ALDH1A1
SCHEMBL11532625 0.87 SRD5A2 (0.55) RXRARXRBSRD5A2SRD5A1ALDH1A1
SCHEMBL11532467 0.86 RHEB (0.55) RXRARXRBALDH1A1RHEBNPC1
SCHEMBL11604724 0.79 XDH (0.42) ALDH1A1CA9KMT2AHPGD
SCHEMBL11607350 0.78 CNR2 (0.47) ALDH1A1CA9HPGD
SCHEMBL11591989 0.77 ALDH1A1 (0.47) ALDH1A1KMT2AHPGD
SCHEMBL18989127 0.75 LMNA (0.47) RXRARXRBSRD5A2SRD5A1ALDH1A1
SCHEMBL11606291 0.75 XDH (0.46) ALDH1A1
SCHEMBL11607595 0.73 PTGER1 (0.46) ALDH1A1RHEBKMT2AMRGPRX4SMN1; SMN2
SCHEMBL14332793 0.73 KDM4E (0.53) ALDH1A1LMNARAB9ACA12CA9

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-4156728-A HYPOTENSIVE MEIJI SEIKA KAISHA, LTD. (JP) 1979-05-29 — — US disclosed
US-4083850-A HYPOTENSIVE AGENTS MEIJI SEIKA KAISHA LTD. (JA) 1978-04-11 — — US disclosed
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