SCHEMBL24018785

SCHEMBL24018785

NNCc1ccccc1OCC1CCCC1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.50
▸ GAA P10253 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ MCHR1 Q99705 3/20 0.46
▸ HTR2C P28335 3/20 0.45
▸ FAAH O00519 1/20 0.41
▸ CNR1 P21554 1/20 0.41
▸ CNR2 P34972 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ SLC6A2 P23975 1/20 0.40
▸ SLC6A4 P31645 1/20 0.40
▸ SLC6A3 Q01959 1/20 0.40
▸ KCNH2 Q12809 1/20 0.40
▸ P2RX4 Q99571 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ C5AR1 P21730 1/20 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
SCHEMBL22957766 0.84 RIPK1 (0.55) RIPK1ALDH1A1MCHR1HTR2CSLC6A2
SCHEMBL22957805 0.83 RIPK1 (0.54) RIPK1ALDH1A1MCHR1HTR2CFAAH
SCHEMBL29786424 0.82 RIPK1 (0.55) RIPK1MCHR1HTR2CFAAHCNR1
SCHEMBL20472415 0.82 RIPK1 (0.55) RIPK1MCHR1HTR2CFAAHCNR1
SCHEMBL22957672 0.82 RIPK1 (0.60) RIPK1MAPTMCHR1HTR2CFAAH
SCHEMBL22957773 0.81 RIPK1 (0.55) RIPK1ALDH1A1MCHR1HTR2CSLC6A2
SCHEMBL20472353 0.81 RIPK1 (0.54) RIPK1MCHR1HTR2CFAAHCNR1
SCHEMBL29786709 0.81 RIPK1 (0.54) RIPK1MCHR1HTR2CFAAHCNR1
SCHEMBL22957804 0.81 RIPK1 (0.51) RIPK1MCHR1FAAHCNR1CNR2
SCHEMBL22957816 0.79 RIPK1 (0.60) RIPK1MAPTMCHR1HTR2CSLC6A2

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
EP-3580220-B1 AMINOTRIAZOLOPYRIDINES AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2021-11-17 — — EP disclosed
Send feedback