SCHEMBL7098971

SCHEMBL7098971

Clc1cccc(C(c2ccccc2)N2CCNCC2)c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.72
KMT2A Q03164 1/20 0.72
CYP2D6 P10635 1/20 0.63
CYP19A1 P11511 1/20 0.63
OPRD1 P41143 7/20 0.60
SLC6A4 P31645 4/20 0.60
SLC6A2 P23975 3/20 0.60
OPRM1 P35372 2/20 0.60
OPRK1 P41145 2/20 0.60
OPRL1 P41146 2/20 0.60
CACNA2D1 P54289 4/20 0.56
CACNA1B Q00975 4/20 0.56
CACNB1 Q02641 4/20 0.56
CACNA1C Q13936 3/20 0.56
CACNA1G O43497 1/20 0.56
TACR1 P25103 1/20 0.54
USP2 O75604 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
SLC6A3 Q01959 1/20 0.50

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
SCHEMBL7101455 0.95 CYP2D6 (0.64) MEN1KMT2ACYP2D6CYP19A1OPRD1
SCHEMBL1741576 0.89 MEN1 (0.74) MEN1KMT2ACYP2D6CYP19A1OPRD1
SCHEMBL11203267 0.85 HTT (0.59) MEN1KMT2ACYP2D6CYP19A1OPRD1
Norchlorcyclizine SCHEMBL6556514 0.85 CYP2D6 (0.86) MEN1KMT2ACYP2D6CYP19A1OPRD1
Norchlorcyclizine SCHEMBL588655 0.85 CYP2D6 (0.86) MEN1KMT2ACYP2D6CYP19A1OPRD1
Norchlorcyclizine SCHEMBL467086 0.85 CYP2D6 (0.86) MEN1KMT2ACYP2D6CYP19A1OPRD1
SCHEMBL219432 0.85 MEN1 (1.00) MEN1KMT2ACYP2D6CYP19A1OPRD1
SCHEMBL2794662 0.85 MEN1 (1.00) MEN1KMT2ACYP2D6CYP19A1OPRD1
Norchlorcyclizine SCHEMBL4649874 0.84 CYP2D6 (0.83) MEN1KMT2ACYP2D6CYP19A1OPRD1
Norchlorcyclizine SCHEMBL588155 0.84 CYP2D6 (0.83) MEN1KMT2ACYP2D6CYP19A1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9365553-B2 Heterocyclic compound and H1 receptor antagonist ASKA PHARMACEUTICAL CO., LTD. (JP) 2016-06-14 US disclosed
US-9365553-B2 Heterocyclic compound and H1 receptor antagonist ASKA PHARMACEUTICAL CO., LTD. (JP) 2016-06-14 US disclosed
EP-2578569-B1 HETEROCYCLIC RING COMPOUND AND H1 RECEPTOR ANTAGONIST ASKA PHARM CO LTD (JP) 2015-10-28 EP disclosed
EP-2578569-A1 HETEROCYCLIC RING COMPOUND AND H1 RECEPTOR ANTAGONIST ASKA Pharmaceutical Co., Ltd. (JP) 2013-04-10 EP disclosed
US-20130085127-A1 HETEROCYCLIC COMPOUND AND H1 RECEPTOR ANTAGONIST ASKA PHARMACEUTICAL CO., LTD (JP) 2013-04-04 US disclosed
US-20130085127-A1 HETEROCYCLIC COMPOUND AND H1 RECEPTOR ANTAGONIST ASKA PHARMACEUTICAL CO., LTD (JP) 2013-04-04 US disclosed
WO-2011148888-A1 HETEROCYCLIC RING COMPOUND AND H1 RECEPTOR ANTAGONIST あすか製薬株式会社 (JP) 2011-12-01 WO disclosed
EP-1020443-B1 PROCESS FOR PRODUCING PIPERAZINESULFONAMIDE DERIVATIVES AND SALTS THEREOF AZWELL INC (JP) 2003-09-10 EP disclosed
US-6172228-B1 Process for producing piperazinesulfonamide derivatives and salts thereof AZWELL INC. (JP) 2001-01-09 US disclosed
EP-1020443-A1 PROCESS FOR PRODUCING PIPERAZINESULFONAMIDE DERIVATIVES AND SALTS THEREOF Azwell Inc. (JP) 2000-07-19 EP disclosed
US-4377578-A ANTIANAPHYLACTIC AGENTS, ANTIHISTAMINES JANSSEN PHARMACEUTICA, N.V. (BE) 1983-03-22 US disclosed
US-4252804-A TRANQUILIZERS, ANTICONVULSANTS, MUSCLE RELAXANTS METABIO-JOULLIE (FR) 1981-02-24 US disclosed
US-4252804-A TRANQUILIZERS, ANTICONVULSANTS, MUSCLE RELAXANTS METABIO-JOULLIE (FR) 1981-02-24 US disclosed
US-4250176-A BENZIMIDAZOLE-2-ONE, BENZOTHIAZOL-2-ONE, OR BENZOXAZOL-2-ONE SUBSTITUTIONS, ANTIANAPHALACTIC AGENTS, ANTIHISTAMINES JANSSEN PHARMACEUTICA N.V. (BE) 1981-02-10 US disclosed
US-4200641-A ANTIANAPHYLACTIC AGENTS, ANTIHISTAMINES JANSSEN PHARMACEUTICA, N.V. (BE) 1980-04-29 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-20130085127-A1 HETEROCYCLIC COMPOUND AND H1 RECEPTOR ANTAGONIST HRH2, HRH4, HRH1 MEN1 2318/4885KMT2A 524/4885CYP2D6 1353/4885

“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.