SCHEMBL6912932

SCHEMBL6912932

CCCCC1=C(C)C(C)=CC1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TYR P14679 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
SCHEMBL6053728 1.00 NPC1 (0.32) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL27482198 0.86
SCHEMBL6913287 0.81 ALOX5 (0.32) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL6810423 0.79 NPC1 (0.31) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL8163903 0.79 NOS2 (0.31) NPC1HPGDMAPK1HTTRAB9A
Hydrochloric Acid SCHEMBL28029831 0.79 NPC1 (0.31) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL27832567 0.79 NPC1 (0.31) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL27446594 0.79 NPC1 (0.31) NPC1HPGDMAPK1HTTRAB9A
Hydrochloric Acid SCHEMBL6811751 0.78
Hydrochloric Acid SCHEMBL967492 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1189435-C Novel transition metal compound and catalyst containing the same for polymerization of olefins JAPAN POLYOLEFINS CO LTD (JP) 2005-02-16 CN disclosed
EP-0969010-B1 Transition metal compound and catalyst containing the same for polymerization of olefins JAPAN POLYOLEFINS CO LTD (JP) 2004-09-22 EP disclosed
US-6352953-B1 TRANSITION METAL COMPLEX HAVING 5-MEMBERED RING FORMED BY TRANSITION METAL COMPOUND OF GROUP IVB, TWO CARBONS, METAL OF GROUP IIIA AND HYDROGEN JAPAN POLYOLEFINS CO., LTD. (JP) 2002-03-05 US disclosed
US-6150544-A Transition metal compound and catalyst containing the same for polymerization of olefins JAPAN POLYOLEFINS CO., LTD. (JP) 2000-11-21 US disclosed
CN-1240782-A Novel transition metal compound and catalyst containing the same for polymerization of olefins JAPAN POLYOLEFINS CO LTD (JP) 2000-01-12 CN disclosed
EP-0969010-A2 Transition metal compound and catalyst containing the same for polymerization of olefins Japan Polyolefins Co., Ltd. (JP) 2000-01-05 EP disclosed