SCHEMBL1387863

SCHEMBL1387863

CN1CCC(c2cccc3ccc(OCc4nc(-c5ccccc5)no4)cc23)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.53
SMN1; SMN2 Q16637 6/20 0.53
NPC1 O15118 5/20 0.53
CASP3 P42574 2/20 0.52
SENP8 Q96LD8 2/20 0.52
SENP7 Q9BQF6 2/20 0.52
SENP6 Q9GZR1 2/20 0.52
TDP1 Q9NUW8 4/20 0.51
MAPK1 P28482 4/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
GSTP1 P09211 3/20 0.46
REN P00797 1/20 0.46
MAPT P10636 9/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
TSHR P16473 4/20 0.44
NPSR1 Q6W5P4 1/20 0.44
FFAR1 O14842 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL7808550 0.84 HTR1A (0.60) RAB9ASMN1; SMN2NPC1CASP3SENP8
SCHEMBL8187068 0.83 ALOX5AP (0.41) RAB9ANPC1CASP3SENP7SENP6
Hydrochloric Acid SCHEMBL1387847 0.82 SLC6A9 (0.58) RAB9ASMN1; SMN2NPC1CASP3SENP8
Hydrochloric Acid SCHEMBL1387849 0.82 SLC6A9 (0.58) RAB9ASMN1; SMN2NPC1CASP3SENP8
SCHEMBL7803605 0.80 HTR1A (0.40) TDP1MAPTTSHR
SCHEMBL7812482 0.80 HTR1A (0.41) TDP1MAPTTSHR
SCHEMBL8568328 0.80 RAB9A (0.66) RAB9ASMN1; SMN2NPC1CASP3SENP8
SCHEMBL8188389 0.79 HTR1A (0.39) TDP1MAPTTSHR
SCHEMBL7816032 0.79 HTR1A (0.41) NPC1TDP1MAPK1L3MBTL1MAPT
SCHEMBL7803556 0.79 SLC6A9 (0.40) TDP1MAPTMEN1KMT2ATSHR

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 9 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
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
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
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