SCHEMBL8048632

SCHEMBL8048632

C=CCc1ccc(-c2ccc(-c3ccc(C=CCCCC(C)O)cn3)cc2)c(F)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.34
RAB9A P51151 4/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 3/20 0.34
HPGD P15428 3/20 0.34
CASP3 P42574 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
MITF O75030 1/20 0.34
KLF5 Q13887 1/20 0.34
TP53 P04637 1/20 0.33
PKM P14618 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CNR2 P34972 2/20 0.32
CNR1 P21554 1/20 0.32
KCNA3 P22001 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31

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
SCHEMBL8048629 1.00 NPC1 (0.34) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL8047603 0.96 SMN1; SMN2 (0.36) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL8047598 0.96 SMN1; SMN2 (0.36) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL8048052 0.94 SMN1; SMN2 (0.36) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL8048055 0.94 SMN1; SMN2 (0.36) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL8054086 0.93 CYP11B1 (0.31) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL8054082 0.93 CYP11B1 (0.31) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL8047852 0.93 KDM4E (0.34) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL8047849 0.93 KDM4E (0.34) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL8046026 0.91 KDM4E (0.32) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0643119-B1 Trans-olefin compounds, method for production thereof, liquid crystal composition containing the same as active ingredient, and liquid crystal element using said composition SUMITOMO CHEMICAL CO (JP) 2000-04-26 EP disclosed
US-6030546-A FERROELECTRIC PHASE; LOW VISCOSITY;, THERMOSENSITIVITY OVER A BROAD AND EXHIBITS A LARGE TILT ANGLE AND A HIGH-SPEED RESPONSE PROPERTY;CHEMICAL INTERMEDIATES FOR PESTICIDES, DRUGS AND LIQUID CRYSTALS; BORIDING AND HYDROLYSIS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-29 US disclosed
US-5707547-A CONTAINING FLUORINATED BENZENE OR NAPHTHALENE RINGS AND/OR NITROGEN CONTAINING HETEROCYCLES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-01-13 US disclosed
EP-0643119-A1 Trans-olefin compounds, method for production thereof, liquid crystal composition containing the same as active ingredient, and liquid crystal element using said composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-03-15 EP disclosed