SCHEMBL142864

SCHEMBL142864

CSc1ccc2c(c1)N(CCCN(C)C)c1ccccc1S2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 11/20 1.00
CYP1A2 P05177 10/20 1.00
ALDH1A1 P00352 3/20 1.00
TP53 P04637 7/20 0.72
HTR1A P08908 6/20 0.72
CYP2C19 P33261 6/20 0.72
DRD2 P14416 5/20 0.72
CHRM2 P08172 5/20 0.72
ADRA2A P08913 5/20 0.72
CHRM1 P11229 5/20 0.72
DRD1 P21728 5/20 0.72
SLC6A2 P23975 5/20 0.72
SLC6A4 P31645 5/20 0.72
ADRA1A P35348 5/20 0.72
OPRM1 P35372 5/20 0.72
DRD3 P35462 5/20 0.72
KCNH2 Q12809 5/20 0.72
THPO P40225 5/20 0.72
MTOR P42345 5/20 0.72
TSHR P16473 5/20 0.72

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
SCHEMBL29385444 1.00 CYP2D6 (1.00) CYP2D6CYP1A2ALDH1A1TP53HTR1A
SCHEMBL13305271 0.88 CYP1A2 (0.78) CYP2D6CYP1A2ALDH1A1TP53HTR1A
Promazine SCHEMBL9052694 0.85 CYP2D6 (1.00) CYP2D6CYP1A2ALDH1A1TP53HTR1A
Promazine SCHEMBL140489 0.85 CYP2D6 (1.00) CYP2D6CYP1A2ALDH1A1TP53HTR1A
Promazine SCHEMBL29392545 0.85 CYP2D6 (1.00) CYP2D6CYP1A2ALDH1A1TP53HTR1A
SCHEMBL9678540 0.85 CYP1A2 (0.73) CYP2D6CYP1A2ALDH1A1TP53HTR1A
SCHEMBL13305247 0.84 CYP1A2 (0.73) CYP2D6CYP1A2ALDH1A1TP53HTR1A
Promazine SCHEMBL123418 0.84 LMNA (1.00) CYP2D6CYP1A2ALDH1A1TP53HTR1A
Promazine SCHEMBL29390978 0.84 LMNA (1.00) CYP2D6CYP1A2ALDH1A1TP53HTR1A
Promazine SCHEMBL27425063 0.84 CYP2D6 (0.97) CYP2D6CYP1A2ALDH1A1TP53HTR1A

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 59 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1976723-A Treatment of infectious diseases BKG PHARMA APS (DK) 2007-06-06 CN claimed
US-20130204238-A1 COMBINATION THERAPY FOLLICA, INC (US) 2013-08-08 US disclosed
EP-2552323-A1 COMBINATION THERAPY Follica, Inc. (US) 2013-02-06 EP disclosed
US-8252749-B2 Methods, kits, and compositions for generating new hair follicles and growing hair FOLLICA, INC. (US) 2012-08-28 US disclosed
US-20120156228-A1 Methods, Kits, and Compositions for Generating New Hair Follicles and Growing Hair FOLLICA, INC. (US) 2012-06-21 US disclosed
WO-2012067630-A1 HAIR GROWTH TREATMENT FOLLICA, INC. (US) 2012-05-24 WO disclosed
WO-2012067631-A1 BODY SURFACE TREATMENT FOLLICA, INC. (US) 2012-05-24 WO disclosed
WO-2012067632-A1 SEQUENTIAL BODY SURFACE TREATMENT FOLLICA, INC. (US) 2012-05-24 WO disclosed
US-20120058979-A1 METHODS AND REAGENTS FOR THE TREATMENT OF IMMUNOINFLAMMATORY DISORDERS ZALICUS INC. (US) 2012-03-08 US disclosed
US-8080553-B2 Methods and reagents for the treatment of immunoinflammatory disorders ZALICUS INC. (US) 2011-12-20 US disclosed
EP-1670427-A2 METHODS AND REAGENTS FOR THE TREATMENT OF IMMUNOINFLAMMATORY DISORDERS CombinatoRx, Incorporated (US) 2006-06-21 EP disclosed
EP-1599212-A4 COMBINATION THERAPY FOR THE TREATMENT OF IMMUNOINFLAMMATORY DISORDERS COMBINATORX INC (US) 2006-02-08 EP disclosed
EP-1599212-A2 COMBINATION THERAPY FOR THE TREATMENT OF IMMUNOINFLAMMATORY DISORDERS Combinatorx, Incorporated (US) 2005-11-30 EP disclosed
US-20050192261-A1 Methods and reagents for the treatment of immunoinflammatory disorders COMBINATORX INCORPORATED 2005-09-01 US disclosed
US-20050119160-A1 Methods and reagents for the treatment of immunoinflammatory disorders ZALICUS INC. 2005-06-02 US disclosed
US-20050112199-A1 Therapeutic regimens for administering drug combinations COMBINATORX, INCORPORATED 2005-05-26 US disclosed
WO-2005030132-A2 THERAPEUTIC REGIMENS FOR ADMINISTERING DRUG COMBINATIONS COMBINATORX, INCORPORATED (US) 2005-04-07 WO disclosed
WO-2005027839-A2 METHODS AND REAGENTS FOR THE TREATMENT OF IMMUNOINFLAMMATORY DISORDERS COMBINATORX, INCORPORATED (US) 2005-03-31 WO disclosed
US-20040224876-A1 Combination therapy for the treatment of immunoinflammatory disorders COMBINATORX, INCORPORATED 2004-11-11 US disclosed
WO-2004073614-A2 COMBINATION THERAPY FOR THE TREATMENT OF IMMUNOINFLAMMATORY DISORDERS COMBINATORX, INCORPORATED (US) 2004-09-02 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 (5 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-20050192261-A1 Methods and reagents for the treatment of immunoinflammatory disorders IL5, CMA1, CCL11 CYP2D6 835/4885CYP1A2 668/4885ALDH1A1 749/4885
US-20040224876-A1 Combination therapy for the treatment of immunoinflammatory disorders HLA-DRB1, TSLP, SERPINA6 CYP2D6 501/4885CYP1A2 773/4885ALDH1A1 2701/4885
US-20120156228-A1 Methods, Kits, and Compositions for Generating New Hair Follicles and Growing Hair NGF, HDGF, SHH CYP2D6 4169/4885CYP1A2 3033/4885ALDH1A1 3080/4885
US-20120058979-A1 METHODS AND REAGENTS FOR THE TREATMENT OF IMMUNOINFLAMMATORY DISORDERS IL5, TPMT, TSLP CYP2D6 981/4885CYP1A2 1083/4885ALDH1A1 1014/4885
US-20050119160-A1 Methods and reagents for the treatment of immunoinflammatory disorders IL5, TPMT, TSLP CYP2D6 981/4885CYP1A2 1083/4885ALDH1A1 1014/4885

“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.