SCHEMBL11264432

SCHEMBL11264432

c1ccc(-n2ccnc2C2CCCCC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ICMT O60725 2/20 0.45
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
MAPK1 P28482 1/20 0.41
TNK2 Q07912 4/20 0.40
HRH1 P35367 1/20 0.40
ATM Q13315 1/20 0.39
TLR7 Q9NYK1 1/20 0.39
KDM4E B2RXH2 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
PKM P14618 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
SCHEMBL27736893 0.98 ICMT (0.46) ICMTNPC1RAB9AMAPK1TNK2
SCHEMBL28779311 0.84 ICMT (0.41) ICMTTNK2TLR7ALDH1A1GFER
SCHEMBL13117192 0.84 ICMT (0.46) ICMTNPC1RAB9ATNK2HRH1
SCHEMBL27736888 0.82 KCNH2 (0.48) ICMTMAPK1TNK2TSHRDRD1
SCHEMBL27736887 0.82 KDR (0.43) ICMTTNK2KDM4ECYP1A2CYP3A4
SCHEMBL27837718 0.81 ICMT (0.40) ICMTTNK2ALDH1A1APOBEC3GFGFR2
SCHEMBL25100064 0.80 TNK2 (0.41) ICMTNPC1RAB9ATNK2LMNA
SCHEMBL28019124 0.77 KCNH2 (0.54) ICMT
SCHEMBL27736889 0.77 ICMT (0.49) ICMTRAB9AATM
SCHEMBL28019125 0.75 KCNH2 (0.55) ICMTCYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4340744-A METAL OXIDES AS CATALYSTS BASF AKTIENGESELLSCHAFT (DE) 1982-07-20 US disclosed
EP-0036129-A1 Process for the preparation of imidazoles BASF Aktiengesellschaft (DE) 1981-09-23 EP disclosed
EP-0000208-B1 PROCESS FOR THE PREPARATION OF IMIDAZOLES BASF Aktiengesellschaft (DE) 1980-04-30 EP disclosed
EP-0000208-A1 Process for the preparation of imidazoles BASF Aktiengesellschaft (DE) 1979-01-10 EP disclosed