SCHEMBL17155199

SCHEMBL17155199

CCc1ccc(Cl)cc1-c1cccc2c1CCNC2

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PNMT P11086 2/20 0.43
CD44 P16070 1/20 0.42
NMT1 P30419 1/20 0.41
CD274 Q9NZQ7 1/20 0.41
S1PR1 P21453 1/20 0.39
S1PR3 Q99500 1/20 0.39
HTR2C P28335 3/20 0.38
HTR2B P41595 3/20 0.38
IRAK4 Q9NWZ3 1/20 0.37
PRCP P42785 1/20 0.37
HTR2A P28223 2/20 0.36
SCN9A Q15858 1/20 0.36
EED O75530 1/20 0.36
RBBP4 Q09028 1/20 0.36
SUZ12 Q15022 1/20 0.36
EZH2 Q15910 1/20 0.36
AEBP2 Q6ZN18 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
SCHEMBL17155489 0.90 PRCP (0.49) PNMTHTR2CHTR2BPRCPHTR2A
SCHEMBL17154240 0.86 S1PR1 (0.41) PNMTCD44NMT1CD274S1PR1
SCHEMBL15700254 0.84 CD44 (0.49) PNMTCD44NMT1CD274HTR2C
SCHEMBL17154233 0.77 PRCP (0.46) PNMTS1PR1S1PR3HTR2CHTR2B
SCHEMBL12942082 0.76 CD44 (0.56) PNMTCD44HTR2CHTR2BPRCP
SCHEMBL14904835 0.70 CD274 (0.56) PNMTCD44CD274HTR2CIRAK4
SCHEMBL17154228 0.69 CD44 (0.45) PNMTCD44CD274S1PR1S1PR3
SCHEMBL17155164 0.69 HTR2C (0.55) HTR2CHTR2A
SCHEMBL12653045 0.68 CSNK2A2 (0.49)
SCHEMBL2750868 0.67 PNMT (0.72) PNMTCD44HTR2CHTR2BPRCP

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-9388179-B2 N-substituted indazole sulfonamide compounds with selective activity in voltage-gated sodium channels MERCK SHARP & DOHME CORP. (US) 2016-07-12 US disclosed
US-20150284389-A1 N-SUBSTITUTED INDAZOLE SULFONAMIDE COMPOUNDS WITH SELECTIVE ACTIVITY IN VOLTAGE-GATED SODIUM CHANNELS MERCK SHARP & DOHME CORP. (US) 2015-10-08 US 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 (1 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-20150284389-A1 N-SUBSTITUTED INDAZOLE SULFONAMIDE COMPOUNDS WITH SELECTIVE ACTIVITY IN VOLTAGE-GATED SODIUM CHANNELS SCN1B, SCN1A, SCN2B PNMT 3290/4885CD44 3081/4885NMT1 3624/4885

“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.