SCHEMBL10791998

SCHEMBL10791998

Cc1ccccc1Cc1cn(Cc2ccccc2C)cn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.51
CYP11B2 P19099 2/20 0.51
KDM5B Q9UGL1 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40
KMT2A Q03164 3/20 0.39
CHRNE Q04844 1/20 0.39
NPC1 O15118 1/20 0.39
GALR3 O60755 1/20 0.39
NR2F2 P24468 1/20 0.39
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 2/20 0.38
LMNA P02545 2/20 0.38
HTT P42858 1/20 0.38
CYP2A13 Q16696 1/20 0.38
KDM4E B2RXH2 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 2/20 0.38
ACHE P22303 1/20 0.37

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
SCHEMBL11049916 0.89 HPGDS (0.43) CYP11B1CYP11B2KDM5BSMN1; SMN2KMT2A
SCHEMBL10792247 0.84 CYP11B1 (0.39) CYP11B1CYP11B2KDM5BSMN1; SMN2KMT2A
SCHEMBL10792085 0.82 CYP11B1 (0.47) CYP11B1CYP11B2KDM5BSMN1; SMN2PTGS1
SCHEMBL6965586 0.80 THRB (0.39) CYP11B1CYP11B2SMN1; SMN2LMNAHTT
SCHEMBL10630490 0.80 CYP2C9 (0.44) CYP11B1CYP11B2KDM5BSMN1; SMN2PTGS1
SCHEMBL24844768 0.79 CYP11B1 (0.53) CYP11B1CYP11B2KDM5BSMN1; SMN2PTGS1
SCHEMBL24845635 0.79 CYP11B1 (0.53) CYP11B1CYP11B2KDM5BSMN1; SMN2PTGS1
SCHEMBL10791602 0.79 PHF8 (0.44) CYP11B1CYP11B2KDM5BSMN1; SMN2KMT2A
SCHEMBL10795248 0.77 PHF8 (0.50) KDM5BSMN1; SMN2KMT2ARAB9ALMNA
SCHEMBL10792191 0.76 CYP11B1 (0.39) CYP11B1CYP11B2SMN1; SMN2NPC1RAB9A

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
US-RE32400-E Substituted imidazole derivatives and their use as anti-thrombosis agents FARMOS YHTYMA OY (FI) 1987-04-14 US disclosed
US-4514412-A HYPOTENSIVES, BETA BLOCKERS FARMOS YHTYMA OY (FI) 1985-04-30 US disclosed
EP-0058047-B1 SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR PREPARATION AND USE Farmos-Yhtyma Oy (FI) 1984-11-07 EP disclosed