SCHEMBL9768245

SCHEMBL9768245

CSc1nn(-c2ncc(C(F)(F)F)cc2Cl)nc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
GAA P10253 2/20 0.46
ATM Q13315 1/20 0.45
SMN1; SMN2 Q16637 4/20 0.44
LMNA P02545 1/20 0.44
RECQL P46063 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
ALDH1A1 P00352 1/20 0.44
GABRP O00591 5/20 0.43
GABRD O14764 5/20 0.43
GABRA1 P14867 5/20 0.43
GABRB1 P18505 5/20 0.43
GABRG2 P18507 5/20 0.43
GABRB3 P28472 5/20 0.43
GABRA5 P31644 5/20 0.43
GABRA3 P34903 5/20 0.43
GABRA2 P47869 5/20 0.43
GABRB2 P47870 5/20 0.43

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
SCHEMBL9768186 0.80 GABRP (0.57) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL6970770 0.76 PKM (0.50) POLBGAASMN1; SMN2L3MBTL1RAB9A
SCHEMBL7814766 0.71 GAA (0.52) POLBGAAATMSMN1; SMN2LMNA
SCHEMBL15639626 0.70 POLB (0.49) POLBGAAATMSMN1; SMN2LMNA
SCHEMBL166766 0.70 ALDH1A1 (0.53) POLBGAASMN1; SMN2LMNAL3MBTL1
SCHEMBL23302308 0.70 GAA (0.51) POLBGAAATMSMN1; SMN2LMNA
SCHEMBL7692554 0.70 GAA (0.46) POLBGAAATMSMN1; SMN2LMNA
SCHEMBL9768243 0.70 KMT2A (0.46) POLBGAAATMSMN1; SMN2LMNA
SCHEMBL14996685 0.69 GAA (0.53) POLBGAAATMSMN1; SMN2LMNA
SCHEMBL19086927 0.69 GAA (0.52) POLBGAAATMSMN1; SMN2LMNA

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-5064844-A Miticides SCHERING AGROCHEMICALS LIMITED (GB) 1991-11-12 US disclosed
EP-0350237-A2 Triazole insecticides SCHERING AGROCHEMICALS LIMITED (GB) 1990-01-10 EP disclosed