SCHEMBL1748393

SCHEMBL1748393

COc1cc(Cl)cc(C(C)Nc2cc(N3CCN(C)CC3)ccc2S(C)(=O)=O)c1OC

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.82
ALK Q9UM73 4/20 0.40
INSR P06213 3/20 0.40
IGF1R P08069 3/20 0.40
ACLY P53396 1/20 0.39
EGFR P00533 3/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
POLB P06746 1/20 0.37
SIRT6 Q8N6T7 1/20 0.37
BRD4 O60885 1/20 0.37
TMEM97 Q5BJF2 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
BMPR1B O00238 2/20 0.37
PLK4 O00444 2/20 0.37
GAK O14976 2/20 0.37
ERN1 O75460 2/20 0.37
STK10 O94804 2/20 0.37
ABL1 P00519 2/20 0.37
LCK P06239 2/20 0.37
FYN P06241 2/20 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
Hydrochloric Acid SCHEMBL1748224 0.99 HTR6 (0.80) HTR6ALKINSRIGF1RACLY
SCHEMBL5021168 0.91 HTR6 (0.68) HTR6ALKINSRIGF1RACLY
SCHEMBL1748316 0.90 HTR6 (1.00) HTR6ALKACLYEGFRACVR1B
SCHEMBL475397 0.90 HTR6 (1.00) HTR6ALKACLYEGFRACVR1B
SCHEMBL1748904 0.90 HTR6 (1.00) HTR6ALKACLYEGFRACVR1B
SCHEMBL5052542 0.90 HTR6 (0.66) HTR6ALKINSRIGF1REGFR
Hydrochloric Acid SCHEMBL475692 0.89 HTR6 (0.98) HTR6ALKACLYEGFRACVR1B
Hydrochloric Acid SCHEMBL1748380 0.89 HTR6 (0.98) HTR6ALKACLYEGFRACVR1B
Hydrochloric Acid SCHEMBL1748258 0.89 HTR6 (0.98) HTR6ALKACLYEGFRACVR1B
SCHEMBL1748333 0.87 HTR6 (0.75) HTR6ALKINSRIGF1RACLY

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7968538-B2 Substituted arylamine compounds and methods of treatment GALENEA CORP. (US) 2011-06-28 US claimed
US-8604021-B2 Substituted arylamine compounds and methods of treatment BECKER OREN (IL) 2013-12-10 US disclosed
US-20120115850-A1 SUBSTITUTED ARYLAMINE COMPOUNDS AND METHODS OF TREATMENT BECKER OREN (IL) 2012-05-10 US disclosed
US-20120115850-A1 SUBSTITUTED ARYLAMINE COMPOUNDS AND METHODS OF TREATMENT BECKER OREN (IL) 2012-05-10 US disclosed
US-7968538-B2 Substituted arylamine compounds and methods of treatment GALENEA CORP. (US) 2011-06-28 US disclosed
US-7968538-B2 Substituted arylamine compounds and methods of treatment GALENEA CORP. (US) 2011-06-28 US disclosed
US-7968538-B2 Substituted arylamine compounds and methods of treatment GALENEA CORP. (US) 2011-06-28 US disclosed
EP-1856075-A1 SUBSTITUTED ARYLAMINE COMPOUNDS AND THEIR USE AS 5-HT6 MODULATORS Epix Delaware, Inc. (US) 2007-11-21 EP disclosed
US-20060205737-A1 Substituted arylamine compounds and methods of treatment GALENEA CORPORATION 2006-09-14 US disclosed
WO-2006081332-A1 SUBSTITUTED ARYLAMINE COMPOUNDS AND THEIR USE AS 5-HT6 MODULATORS EPIX DELAWARE, INC. (US) 2006-08-03 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 (2 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-20120115850-A1 SUBSTITUTED ARYLAMINE COMPOUNDS AND METHODS OF TREATMENT HTR6, HTR2A, HTR3B HTR6 1/4885ALK 658/4885INSR 101/4885
US-20060205737-A1 Substituted arylamine compounds and methods of treatment HTR6, HTR2A, HTR3B HTR6 1/4885ALK 658/4885INSR 101/4885

“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.