SCHEMBL11369368

SCHEMBL11369368

C=CCCn1c(=O)c(C(=O)O)c(O)c2cc(OC)c(OC)cc21

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 1/20 0.50
▸ MEN1 O00255 6/20 0.47
▸ KMT2A Q03164 6/20 0.47
▸ HPGD P15428 2/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ HTT P42858 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ LMNA P02545 2/20 0.39
▸ TSHR P16473 2/20 0.39
▸ FEN1 P39748 2/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ ATM Q13315 1/20 0.37

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
SCHEMBL11372364 0.88 RXFP1 (0.62) RXFP1MEN1KMT2AHPGDHSD17B10
SCHEMBL11383233 0.87 LMNA (0.53) RXFP1MEN1KMT2AHPGDHSD17B10
SCHEMBL11372327 0.85 ALDH1A1 (0.53) RXFP1MEN1KMT2AHPGDHSD17B10
SCHEMBL11372417 0.81 RXFP1 (0.45) RXFP1MEN1KMT2AHPGDHSD17B10
SCHEMBL11365331 0.81 RXFP1 (0.54) RXFP1MEN1KMT2AHPGDHSD17B10
SCHEMBL11445559 0.80 RXFP1 (0.40) RXFP1MEN1KMT2AHPGDMAPT
SCHEMBL11365043 0.80 RXFP1 (0.53) RXFP1MEN1KMT2AHPGDHSD17B10
SCHEMBL11373100 0.79 MEN1 (0.50) MEN1KMT2AALDH1A1TSHRFEN1
SCHEMBL11642713 0.78 ALDH1A1 (0.53) RXFP1MEN1KMT2AHPGDHSD17B10
SCHEMBL11372185 0.78 RXFP1 (0.42) RXFP1MEN1KMT2AHPGDHTT

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-4281131-A ANTIALLERGENS SANDOZ, INC. (US) 1981-07-28 — — US disclosed
US-4187309-A ANTIALLERGENS, ANTIHISTAMINES SANDOZ, INC. (US) 1980-02-05 — — US disclosed
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