SCHEMBL17154232

SCHEMBL17154232

CC(C)Cc1ccc(Cl)cc1C1=CCNCCC1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.42
EHMT2 Q96KQ7 6/20 0.41
EHMT1 Q9H9B1 6/20 0.41
HTR6 P50406 7/20 0.41
SIGMAR1 Q99720 1/20 0.40
MAPT P10636 1/20 0.38
HTR1B P28222 1/20 0.38
HTR2A P28223 1/20 0.38
HTR7 P34969 1/20 0.38
HTR3A P46098 1/20 0.38
INPPL1 O15357 1/20 0.38
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34

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
SCHEMBL17154231 0.92 HTR2C (0.51) HTR2CHTR6SIGMAR1MAPTHTR1B
SCHEMBL17155483 0.85 HTR6 (0.46) HTR2CEHMT2EHMT1HTR6SIGMAR1
SCHEMBL17154239 0.81 HTR2C (0.41) HTR2CEHMT2EHMT1HTR6SIGMAR1
SCHEMBL17155164 0.77 HTR2C (0.55) HTR2CHTR6SIGMAR1MAPTHTR1B
SCHEMBL14704899 0.69 SIGMAR1 (0.79) HTR2CHTR6SIGMAR1MAPTHTR1B
SCHEMBL20841540 0.69 RGS12 (0.31)
SCHEMBL4329636 0.69 HTR2C (0.60) HTR2CEHMT2EHMT1HTR6SIGMAR1
SCHEMBL17154240 0.67 S1PR1 (0.41) HTR2CHTR2A
SCHEMBL17154233 0.67 PRCP (0.46) HTR2CHTR2A
SCHEMBL14704909 0.66 HTR2C (0.82) HTR2CSIGMAR1HTR7

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 HTR2C 436/4885EHMT2 2834/4885EHMT1 2474/4885

“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.