SCHEMBL11372185

SCHEMBL11372185

CC#CCn1c(=O)c(C(=O)O)c(O)c2cc(OC)c(OC)cc21

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 1/20 0.42
▸ TSHR P16473 2/20 0.40
▸ HTT P42858 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ MEN1 O00255 4/20 0.40
▸ KMT2A Q03164 4/20 0.40
▸ FEN1 P39748 2/20 0.39
▸ ATM Q13315 2/20 0.37
▸ MAPT P10636 5/20 0.37
▸ ALDH1A1 P00352 4/20 0.37
▸ HPGD P15428 2/20 0.37
▸ ALOX12 P18054 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ TP53 P04637 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.35
▸ POLB P06746 1/20 0.35

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
SCHEMBL11380622 0.86 ALDH1A1 (0.50) RXFP1HTTLMNAALDH1A1SMN1; SMN2
SCHEMBL11639817 0.83 RXFP1 (0.45) RXFP1TSHRHTTLMNAMEN1
SCHEMBL11372327 0.81 ALDH1A1 (0.53) RXFP1TSHRHTTLMNAMEN1
SCHEMBL11372417 0.80 RXFP1 (0.45) RXFP1TSHRHTTLMNAMEN1
SCHEMBL11372364 0.80 RXFP1 (0.62) RXFP1TSHRHTTLMNAMEN1
SCHEMBL11381859 0.79 HIF1A (0.46) RXFP1TSHRHTTLMNAMEN1
SCHEMBL11369368 0.78 RXFP1 (0.50) RXFP1TSHRHTTLMNAMEN1
SCHEMBL11373100 0.77 MEN1 (0.50) TSHRMEN1KMT2AFEN1ATM
SCHEMBL11365331 0.72 RXFP1 (0.54) RXFP1TSHRHTTLMNAMEN1
SCHEMBL11365043 0.71 RXFP1 (0.53) RXFP1TSHRHTTLMNAMEN1

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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