SCHEMBL20069900

SCHEMBL20069900

COc1ccc(CN2C(C)CNCC2C)cn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.43
TRPV6 Q9H1D0 1/20 0.43
CHRNB2 P17787 5/20 0.42
CHRNA4 P43681 5/20 0.42
CHRNB4 P30926 2/20 0.42
CHRNA3 P32297 2/20 0.42
CHRNA7 P36544 1/20 0.42
RET P07949 3/20 0.42
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
CACNA1G O43497 1/20 0.41
CACNA1H O95180 1/20 0.41
CACNA1I Q9P0X4 1/20 0.41
NAAA Q02083 1/20 0.40
KDM1A O60341 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
JAK2 O60674 1/20 0.39
JAK1 P23458 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
SCHEMBL20069899 1.00 CYP11B1 (0.43) CYP11B1TRPV6CHRNB2CHRNA4CHRNB4
Trifluoroacetic Acid SCHEMBL20136779 0.88 CACNA1G (0.44) CYP11B1TRPV6CHRNB2CHRNA4RET
SCHEMBL22666989 0.84 CHRNB2 (0.46) CYP11B1TRPV6CHRNB2CHRNA4CHRNB4
SCHEMBL20153149 0.83 RET (0.46) CYP11B1TRPV6CHRNB2CHRNA4CHRNB4
SCHEMBL24624328 0.82 TRPV6 (0.43) CYP11B1TRPV6CHRNB2CHRNA4CHRNB4
SCHEMBL22796161 0.82 TRPV6 (0.43) CYP11B1TRPV6CHRNB2CHRNA4CHRNB4
SCHEMBL25220183 0.81 TRPV6 (0.42) CYP11B1TRPV6CHRNB2CHRNA4CHRNB4
Hydrochloric Acid SCHEMBL29597371 0.81 TRPV6 (0.42) CYP11B1TRPV6CHRNB2CHRNA4CHRNB4
SCHEMBL22030910 0.81 CHRNB2 (0.43) CYP11B1TRPV6CHRNB2CHRNA4CHRNB4
Hydrochloric Acid SCHEMBL25216416 0.80 TRPV6 (0.42) CYP11B1TRPV6CHRNB2CHRNA4CHRNB4

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
EP-3753939-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS Array Biopharma Inc. (US) 2020-12-23 EP disclosed
EP-3523301-B1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2020-05-27 EP disclosed
WO-2018071447-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ANDREWS STEVEN W (US) 2018-04-19 WO disclosed