SCHEMBL11263547

SCHEMBL11263547

[O-][S+](Cc1ccccn1)c1ccccc1F

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.42
HSD17B10 Q99714 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
LMNA P02545 1/20 0.38
TAAR1 Q96RJ0 1/20 0.38
ALDH1A1 P00352 1/20 0.38
ALOX15 P16050 1/20 0.38
SYK P43405 1/20 0.37
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
LIN28A Q9H9Z2 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
KDM4E B2RXH2 1/20 0.37
KCNA5 P22460 1/20 0.37
RAB9A P51151 1/20 0.36
CHRNA7 P36544 1/20 0.36

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
SCHEMBL11251707 0.80 CTNNB1 (0.40) HRH1HSD17B10LMNAALDH1A1MAPT
SCHEMBL11183688 0.78 HRH1 (0.39) HRH1HRH3LMNATAAR1ALDH1A1
SCHEMBL11189445 0.77 RAB9A (0.46) HRH1LMNAALDH1A1MAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL9756590 0.75 HRH1 (0.42) HRH1HRH3LMNATAAR1ALDH1A1
SCHEMBL11253725 0.75 MAOA (0.43) HRH1HRH3LMNATAAR1ALDH1A1
SCHEMBL4612152 0.74 HRH3 (0.46) HRH1HRH3LMNATAAR1ALDH1A1
SCHEMBL28140567 0.74 HRH3 (0.46) HRH1HRH3LMNATAAR1ALDH1A1
SCHEMBL28319826 0.74 HRH1 (0.48) HRH1HRH3LMNATAAR1ALDH1A1
SCHEMBL9113864 0.72 CSNK1A1 (0.43) HSD17B10HRH3LMNAALDH1A1MAPT
SCHEMBL12854110 0.72 HRH3 (0.43) HRH1HRH3LMNATAAR1ALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4327102-A TREATING ULCERS AND HYPERSECRETION JOHN WYETH & BROTHER LIMITED (GB) 1982-04-27 US claimed