SCHEMBL10985371

SCHEMBL10985371

CCCCCCCCCCCCCCCCCCCCc1cc2cc(C(=O)O)ccc2[nH]1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.51
RARB P10826 7/20 0.48
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
RARA P10276 1/20 0.48
MAPT P10636 1/20 0.48
MTOR P42345 1/20 0.48
KMT2A Q03164 1/20 0.48
GHSR Q92847 3/20 0.47
CTSV O60911 1/20 0.47
CTSL P07711 1/20 0.47
HCAR2 Q8TDS4 1/20 0.46
PLA2G4A P47712 1/20 0.46
TP53 P04637 1/20 0.46
TSHR P16473 1/20 0.46

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
SCHEMBL10979118 1.00 HRH3 (0.51) HRH3RARBMEN1ALDH1A1RARA
SCHEMBL10989313 1.00 HRH3 (0.51) HRH3RARBMEN1ALDH1A1RARA
SCHEMBL10979939 1.00 HRH3 (0.51) HRH3RARBMEN1ALDH1A1RARA
SCHEMBL10988273 1.00 HRH3 (0.51) HRH3RARBMEN1ALDH1A1RARA
SCHEMBL6948860 1.00 HRH3 (0.51) HRH3RARBMEN1ALDH1A1RARA
SCHEMBL10988758 1.00 HRH3 (0.51) HRH3RARBMEN1ALDH1A1RARA
SCHEMBL10981244 1.00 HRH3 (0.51) HRH3RARBMEN1ALDH1A1RARA
SCHEMBL10985255 1.00 HRH3 (0.51) HRH3RARBMEN1ALDH1A1RARA
SCHEMBL10980000 1.00 HRH3 (0.51) HRH3RARBMEN1ALDH1A1RARA
SCHEMBL10985932 1.00 HRH3 (0.51) HRH3RARBMEN1ALDH1A1RARA

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-4493843-A Indole and indoline carboxylic acid compounds and method of use MAY & BAKER LIMITED (GB) 1985-01-15 US disclosed
EP-0042298-B1 INDOLE AND INDOLINE DERIVATIVES MAY & BAKER LIMITED (GB) 1984-09-12 EP disclosed
EP-0042298-A1 Indole and indoline derivatives MAY & BAKER LIMITED (GB) 1981-12-23 EP disclosed