SCHEMBL144450

SCHEMBL144450

CCC(N1CCNCC1)N1c2ccccc2Sc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 7/20 0.50
MAOA P21397 2/20 0.39
BCHE P06276 3/20 0.38
MAPT P10636 2/20 0.38
GAA P10253 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
PTGS1 P23219 2/20 0.38
PTGS2 P35354 2/20 0.38
KDM4E B2RXH2 1/20 0.38
SLC22A1 O15245 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
CHRM2 P08172 1/20 0.38
HTR1A P08908 1/20 0.38
ADRA2A P08913 1/20 0.38
CYP2D6 P10635 1/20 0.38
CHRM1 P11229 1/20 0.38

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
SCHEMBL9331502 0.76 DRD3 (0.44) KDM1AMAPTMEN1KMT2ASLC6A2
Hydrochloric Acid SCHEMBL9331483 0.76 DRD3 (0.44) KDM1ABCHEMAPTMEN1KMT2A
SCHEMBL8973036 0.74 BCHE (0.41) KDM1ABCHEMAPTGAAALDH1A1
SCHEMBL9331583 0.72 LMNA (0.37) KDM1ABCHEMAPTMEN1KMT2A
SCHEMBL9332058 0.72 HDAC3 (0.45) BCHEMAPTMEN1KMT2ASLC6A2
Hydrochloric Acid SCHEMBL9332079 0.72 HRH1 (0.43) BCHEMAPTMEN1KMT2ASLC6A2
SCHEMBL9759044 0.71 LMNA (0.42) KDM1AMAOABCHEMAPTSLC6A2
SCHEMBL6556075 0.70 SLC6A4 (0.36) MEN1KMT2ASLC6A2SLC6A4CYP2D6
SCHEMBL9759278 0.70 USP2 (0.34) KDM1ABCHEMAPTPTGS1PTGS2
SCHEMBL12386881 0.70 PTGS1 (0.51) MAOABCHEMAPTGAAKMT2A

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
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
WO-2011123218-A1 COMBINATION THERAPY FOLLICA, INC. (US) 2011-10-06 WO disclosed
WO-2005037203-A2 METHODS AND REAGENTS FOR THE TREATMENT OF IMMUNOINFLAMMATORY DISORDERS COMBINATORX, INCORPORATED (US) 2005-04-28 WO disclosed
WO-2005030132-A2 THERAPEUTIC REGIMENS FOR ADMINISTERING DRUG COMBINATIONS COMBINATORX, INCORPORATED (US) 2005-04-07 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
EP-0100033-B1 SUBSTITUTED (10H-PHENOTHIAZIN-10-YL)PROPYL-1-PIPERAZINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEREAPEUTIC AGENTS CONTAINING THEM F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1987-01-14 EP disclosed
EP-0100033-B1 SUBSTITUTED (10H-PHENOTHIAZIN-10-YL)PROPYL-1-PIPERAZINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEREAPEUTIC AGENTS CONTAINING THEM F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1987-01-14 EP disclosed
US-4471116-A Substituted (10H-phenothiazin-10-L)-propyl-1-piperazines HOFFMANN-LA ROCHE INC. (US) 1984-09-11 US disclosed
EP-0100033-A1 Substituted (10H-phenothiazin-10-yl)propyl-1-piperazine derivatives, process for their preparation and thereapeutic agents containing them F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1984-02-08 EP disclosed
EP-0100033-A1 Substituted (10H-phenothiazin-10-yl)propyl-1-piperazine derivatives, process for their preparation and thereapeutic agents containing them F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1984-02-08 EP disclosed
EP-0100033-A1 Substituted (10H-phenothiazin-10-yl)propyl-1-piperazine derivatives, process for their preparation and thereapeutic agents containing them F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1984-02-08 EP 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 (3 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-20040224876-A1 Combination therapy for the treatment of immunoinflammatory disorders HLA-DRB1, TSLP, SERPINA6 KDM1A 4496/4885MAOA 1263/4885BCHE 392/4885
US-20120156228-A1 Methods, Kits, and Compositions for Generating New Hair Follicles and Growing Hair NGF, HDGF, SHH KDM1A 2646/4885MAOA 1168/4885BCHE 2980/4885
US-20120058979-A1 METHODS AND REAGENTS FOR THE TREATMENT OF IMMUNOINFLAMMATORY DISORDERS IL5, TPMT, TSLP KDM1A 3260/4885MAOA 1359/4885BCHE 1133/4885

“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.