SCHEMBL1387940

SCHEMBL1387940

CN1CCC(c2cccc3ccc(Oc4ncccn4)cc23)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 3/20 0.46
HTR2A P28223 1/20 0.46
HTR2B P41595 1/20 0.46
MTNR1A P48039 2/20 0.45
RAB9A P51151 1/20 0.44
HRH3 Q9Y5N1 2/20 0.43
HTR1A P08908 2/20 0.42
HTR1D P28221 2/20 0.42
HTR1B P28222 2/20 0.42
DRD2 P14416 1/20 0.41
SLC6A4 P31645 1/20 0.41
OPRM1 P35372 1/20 0.39
OPRL1 P41146 1/20 0.39
NPC1 O15118 1/20 0.38
MAPT P10636 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MTNR1B P49286 1/20 0.36

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
SCHEMBL9325324 0.85 MTNR1A (0.56) MTNR1AHTR1AHTR1DHTR1BDRD2
SCHEMBL6313399 0.78 HTR1A (0.69) HTR6HTR2ARAB9AHTR1AHTR1D
SCHEMBL6313386 0.76 MTNR1A (0.46) HTR6MTNR1ADRD2SLC6A4MTNR1B
SCHEMBL8185072 0.75 DRD2 (0.50) HTR6HTR2AHTR2BHRH3HTR1A
SCHEMBL6308711 0.75 USP2 (0.47) MTNR1AHTR1ADRD2SLC6A4ALDH1A1
SCHEMBL6306397 0.74 HTR6 (0.48) HTR6HTR2AHTR2BMTNR1ADRD2
SCHEMBL7816263 0.74 CYP1A2 (0.57) HRH3DRD2SLC6A4MAPT
SCHEMBL6307121 0.74 HTR1D (0.57) HTR6HTR2AHTR2BHRH3HTR1D
SCHEMBL7803546 0.73 HTR1A (0.42) HTR6HTR2AHTR2BMTNR1AHRH3
SCHEMBL7810666 0.73 MTNR1A (0.41) HTR2AMTNR1AHTR1AHTR1DHTR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0767782-B1 ARYL AND HETEROARYL ALKOXYNAPHTHALENE DERIVATIVES PFIZER (US) 2001-10-31 EP claimed
EP-0795328-A1 Use of naphthalene derivatives in treating lung carcinoma PFIZER INC. (US) 1997-09-17 EP claimed
JP-H09506638-A 1997-06-30 JP claimed
EP-0767782-A1 ARYL AND HETEROARYL ALKOXYNAPHTHALENE DERIVATIVES PFIZER INC. (US) 1997-04-16 EP claimed
WO-1996000720-A1 ARYL AND HETEROARYL ALKOXYNAPHTHALENE DERIVATIVES PFIZER INC. (US) 1996-01-11 WO claimed
WO-2020183011-A1 HTR1D INHIBITORS AND USES THEREOF IN THE TREATMENT OF CANCER INSTITUT CURIE (FR) 2020-09-17 WO disclosed
EP-0767782-B1 ARYL AND HETEROARYL ALKOXYNAPHTHALENE DERIVATIVES PFIZER (US) 2001-10-31 EP disclosed
US-6166020-A Aryl and heteroaryl alkoxynaphthalene derivatives PFIZER INC. (US) 2000-12-26 US disclosed
US-5821245-A Use of naphthalene derivatives in treating lung carcinoma PFIZER INC. (US) 1998-10-13 US disclosed
EP-0795328-A1 Use of naphthalene derivatives in treating lung carcinoma PFIZER INC. (US) 1997-09-17 EP disclosed
EP-0767782-A1 ARYL AND HETEROARYL ALKOXYNAPHTHALENE DERIVATIVES PFIZER INC. (US) 1997-04-16 EP disclosed
WO-1996000720-A1 ARYL AND HETEROARYL ALKOXYNAPHTHALENE DERIVATIVES PFIZER INC. (US) 1996-01-11 WO disclosed