SCHEMBL9925348

SCHEMBL9925348

Cc1nc2ccc(F)cn2c1C

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 12/20 0.53
CYP11B2 P19099 12/20 0.53
CYP19A1 P11511 2/20 0.40
CYP3A4 P08684 1/20 0.40
GABRA1 P14867 2/20 0.39
GABRB2 P47870 2/20 0.39
MCHR1 Q99705 2/20 0.38
ALDH1A3 P47895 1/20 0.37
HTR6 P50406 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL16540967 0.81 CYP11B1 (0.43) CYP11B1CYP11B2CYP19A1CYP3A4GABRA1
SCHEMBL22145957 0.81 CYP11B1 (0.43) CYP11B1CYP11B2CYP19A1CYP3A4GABRA1
SCHEMBL14809711 0.81 CYP11B1 (0.50) CYP11B1CYP11B2CYP19A1CYP3A4GABRA1
SCHEMBL1322438 0.81 CYP11B1 (0.50) CYP11B1CYP11B2CYP19A1CYP3A4GABRA1
SCHEMBL12832005 0.79 COMT (0.51) CYP11B1CYP11B2GAA
SCHEMBL24242352 0.78 CYP11B1 (0.48) CYP11B1CYP11B2CYP19A1CYP3A4GABRA1
SCHEMBL18135592 0.78 CYP11B1 (0.48) CYP11B1CYP11B2CYP19A1CYP3A4GABRA1
SCHEMBL25527215 0.78 CYP11B1 (0.42) CYP11B1CYP11B2CYP19A1CYP3A4GABRA1
SCHEMBL22146339 0.78 CYP11B1 (0.41) CYP11B1CYP11B2CYP19A1CYP3A4GABRA1
SCHEMBL16160311 0.78 CYP11B1 (0.48) CYP11B1CYP11B2CYP19A1CYP3A4GABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220332713-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2022-10-20 US disclosed
US-20160280685-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2016-09-29 US disclosed
US-20160214978-A1 SUBSTITUTED PYRIMIDINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2016-07-28 US disclosed
US-20120149699-A1 IMIDAZO[1,2-a]PYRIDINE SULFONAMIDES AS TRPM8 MODULATORS JANSSEN PHARMACEUTICA, NV (BE) 2012-06-14 US disclosed
WO-2012078994-A1 IMIDAZO [1, 2-A] PYRIDINE SULFONAMIDES AS TRPM8 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2012-06-14 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220332713-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP CYP11B1 1168/4885CYP11B2 1579/4885CYP19A1 425/4885
US-20120149699-A1 IMIDAZO[1,2-a]PYRIDINE SULFONAMIDES AS TRPM8 MODULATORS TRPM8, TRPV1, TRPM2 CYP11B1 3773/4885CYP11B2 3606/4885CYP19A1 3945/4885
US-20160280685-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS BMI1, BAZ2A, BAZ2B CYP11B1 3753/4885CYP11B2 4388/4885CYP19A1 3735/4885
US-20160214978-A1 SUBSTITUTED PYRIMIDINE BMI-1 INHIBITORS BMI1, BAZ2A, BRPF3 CYP11B1 4223/4885CYP11B2 4662/4885CYP19A1 3916/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.