SCHEMBL318816

SCHEMBL318816

Fc1ccc(C(CCCCl)c2ccc(F)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 9/20 0.47
SCN5A Q14524 1/20 0.44
SLC6A3 Q01959 2/20 0.43
CACNA1B Q00975 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HTR2A P28223 2/20 0.39
HRH1 P35367 2/20 0.39
FAAH O00519 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
TSHR P16473 1/20 0.38
ALOX12 P18054 1/20 0.38
MAPK1 P28482 1/20 0.38
MTOR P42345 1/20 0.38
RAB9A P51151 1/20 0.38
CACNA1F O60840 1/20 0.38
HTR1A P08908 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
DRD4 P21917 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
SCHEMBL11831791 0.94 CYP19A1 (0.51) CYP19A1SCN5ASLC6A3MEN1KMT2A
SCHEMBL7331536 0.94 CYP19A1 (0.46) CYP19A1SCN5ASLC6A3CACNA1BMEN1
SCHEMBL11800229 0.88 CYP19A1 (0.51) CYP19A1SCN5ASLC6A3HTR2AHRH1
SCHEMBL7382843 0.86 CYP19A1 (0.44) CYP19A1SCN5ASLC6A3CACNA1BMEN1
SCHEMBL6578930 0.81 AOC3 (0.47) MEN1KMT2ACYP3A4TSHRMTOR
SCHEMBL6577383 0.81 AOC3 (0.47) MEN1KMT2ACYP3A4TSHRMTOR
SCHEMBL6577385 0.81 AOC3 (0.47) MEN1KMT2ACYP3A4TSHRMTOR
SCHEMBL6700730 0.80 CYP19A1 (0.49) CYP19A1SCN5ASLC6A3CACNA1BHTR2A
SCHEMBL7333341 0.80 CNR1 (0.41) SLC6A3MEN1KMT2AHTR2AHRH1
SCHEMBL5635206 0.79 HRH1 (0.60) CYP19A1SLC6A3HTR2AHRH1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016071723-A1 PROCESS FOR THE PREPARATION OF A FLUSPIRILENE INTERMEDIATE SIFAVITOR S.R.L. (IT) 2016-05-12 WO claimed
EP-2357172-B1 Process for the preparation of pimozide INST UNIV CIENCIA I TECNOLOGIA (ES) 2012-10-31 EP claimed
EP-2357172-A1 Process for the preparation of pimozide Institut Univ. de Ciència i Tecnologia, S.A. (ES) 2011-08-17 EP claimed
EP-2132175-A2 PROCESS FOR THE PREPARATION OF LOPERAMIDE Institut Universitari de Ciència i Tecnologia (ES) 2009-12-16 EP claimed
WO-2008080601-A2 PROCESS FOR THE PREPARATION OF LOPERAMIDE INSTITUT UNIVERSITARI DE CIÈNCIA I TECNOLOGIA (ES) 2008-07-10 WO claimed
JP-10218866-A None JP disclosed
EP-3138841-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE Altos Therapeutics, LLC (US) 2017-03-08 EP disclosed
WO-2016071723-A1 PROCESS FOR THE PREPARATION OF A FLUSPIRILENE INTERMEDIATE SIFAVITOR S.R.L. (IT) 2016-05-12 WO disclosed
WO-2016071723-A1 PROCESS FOR THE PREPARATION OF A FLUSPIRILENE INTERMEDIATE SIFAVITOR S.R.L. (IT) 2016-05-12 WO disclosed
US-9156840-B2 D2 antagonists, methods of synthesis and methods of use Altos Therapeutics, LLC (US) 2015-10-13 US disclosed
US-9000174-B2 4-phenylsulfonamidopiperidines as calcium channel blockers PURDUE PHARMA L.P. (US) 2015-04-07 US disclosed
US-9000174-B2 4-phenylsulfonamidopiperidines as calcium channel blockers PURDUE PHARMA L.P. (US) 2015-04-07 US disclosed
US-4131611-A ANXIOLYTIC, ANALGESIC AMERICAN CYANAMID COMPANY (US) 1978-12-26 US disclosed
US-4128552-A ANTIPSYCHOTIC WARNER-LAMBERT COMPANY (US) 1978-12-05 US disclosed
US-3989707-A NEUROLEPTIC AGENTS JANSSEN PHARMACEUTICA N.V. (BE) 1976-11-02 US disclosed
US-3985889-A 1,3-DIHYDROSPIRO(ISOBENZOFURAN); ANALGETIC AGENTS AMERICAN HOECHST CORPORATION (US) 1976-10-12 US disclosed
US-3965180-A CNS DEPRESSANT THE UPJOHN COMPANY (US) 1976-06-22 US disclosed
US-3962259-A TRANQUILIZERS, ANALGETIC AGENTS AMERICAN HOECHST CORPORATION (US) 1976-06-08 US disclosed
US-3960961-A 4'-Fluoro-4-{[4-(phenyl)cyclohexyl]amino}butyrophenones and the salts thereof THE UPJOHN COMPANY (US) 1976-06-01 US disclosed
US-3952025-A ANALGESIC, TRANQUILIZER AMERICAN HOECHST CORPORATION (US) 1976-04-20 US disclosed