SCHEMBL10850431

SCHEMBL10850431

FC(F)(F)c1cc(Cl)c2[nH]ncc2n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 2/20 0.42
▸ NOS1 P29475 3/20 0.38
▸ TRPA1 O75762 2/20 0.36
▸ TRPM8 Q7Z2W7 1/20 0.36
▸ TRPV1 Q8NER1 1/20 0.36
▸ METAP2 P50579 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ HTT P42858 2/20 0.32
▸ PTK2 Q05397 1/20 0.32
▸ NOTUM Q6P988 2/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ SLC2A1 P11166 1/20 0.31
▸ FABP4 P15090 1/20 0.31
▸ HSP90AA1 P07900 1/20 0.31
▸ HSP90AB1 P08238 1/20 0.31
▸ DYRK1A Q13627 1/20 0.31
▸ ADRB2 P07550 1/20 0.31
▸ RPS6KB1 P23443 1/20 0.30

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
SCHEMBL35211500 0.75 METAP2 (0.39) NT5ENOS1TRPA1TRPM8TRPV1
SCHEMBL6850243 0.74 SLC2A1 (0.44) NOS1HTTPTK2SLC2A1DYRK1A
SCHEMBL29864632 0.71 NOS1 (0.34) NOS1TRPA1TRPM8TRPV1METAP2
SCHEMBL31091998 0.70 ADRB2 (0.37) METAP2ADRB2
SCHEMBL10846163 0.70 TLR7 (0.57) HTTSLC2A1
SCHEMBL10847105 0.69 GPR35 (0.41) NOS1ALDH1A1HSD17B10
SCHEMBL35211775 0.68 METAP2 (0.39) NT5ENOS1TRPA1TRPM8TRPV1
SCHEMBL29626644 0.67 METAP2 (0.44) NOS1TRPA1TRPM8TRPV1METAP2
SCHEMBL21851687 0.67 METAP2 (0.37) TRPA1TRPM8METAP2ALDH1A1GAA
SCHEMBL10124513 0.67 METAP2 (0.44) NOS1TRPA1TRPM8TRPV1METAP2

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
CN-114450271-B Ureas, amino and substituted heteroaryl compounds for Cbl-b inhibition 纽力克斯治疗公司 2024-09-20 — — CN disclosed
US-4621089-A Pyrazolopyridine derivatives and their use in treating inflammation and allergic conditions BEECHAM GROUP P.L.C. (GB) 1986-11-04 — — US disclosed
EP-0154220-A2 Pyrazolopyridine derivatives BEECHAM GROUP PLC (GB) 1985-09-11 — — EP disclosed
Send feedback