SCHEMBL9841277

SCHEMBL9841277

CC(C)=CCOc1ccccn1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.40
NPC1 O15118 3/20 0.39
ALDH1A1 P00352 3/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
RAB9A P51151 2/20 0.38
GABRA5 P31644 1/20 0.37
KDM4E B2RXH2 4/20 0.37
LMNA P02545 3/20 0.37
CCR1 P32246 2/20 0.37
CCR5 P51681 2/20 0.37
CCR8 P51685 2/20 0.37
CYP1A2 P05177 1/20 0.37
POLB P06746 1/20 0.37
METAP1 P53582 1/20 0.37
BLM P54132 1/20 0.37
HIF1A Q16665 1/20 0.37
DOHH Q9BU89 1/20 0.37
P4HTM Q9NXG6 1/20 0.37

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
SCHEMBL9272903 0.86 LTA4H (0.41) TSHRALDH1A1CYP2D6CYP2C19KDM4E
SCHEMBL7540188 0.86 ALOX15 (0.48) ALDH1A1KDM4EALOX15L3MBTL1MAPK1
SCHEMBL9271566 0.79 NDUFS8 (0.35) TSHRNPC1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL3476978 0.79 NPC1 (0.42) TSHRNPC1ALDH1A1CYP2D6CYP2C19
SCHEMBL9274162 0.77 NDUFS8 (0.36) NPC1ALDH1A1RAB9AKDM4ELMNA
SCHEMBL29232611 0.76 NPC1 (0.40) TSHRNPC1ALDH1A1CYP2D6CYP2C19
SCHEMBL11209912 0.76 NPC1 (0.40) TSHRNPC1ALDH1A1CYP2D6CYP2C19
SCHEMBL938005 0.75 NPC1 (0.42) TSHRNPC1ALDH1A1CYP2D6CYP2C19
SCHEMBL3260151 0.75 CHRNB2 (0.44) TSHRNPC1ALDH1A1CYP2D6CYP2C19
SCHEMBL31124123 0.75 NPC1 (0.42) TSHRNPC1ALDH1A1CYP2D6CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5077046-A Plant extracts; mannaliam dolichols intermediates KURARAY CO., LTD. (JP) 1991-12-31 US disclosed
US-5012018-A Extending polyisoprene chain using copper catalyst KURARAY CO., LTD. (JP) 1991-04-30 US disclosed
US-4886904-A CONTAINING CIS AND TRANS ISOPRENE UNITS KURARAY CO., LTD. (JP) 1989-12-12 US disclosed
EP-0054753-B1 POLYPRENYL COMPOSITION OR COMPOUNDS AND PROCESS FOR THE PRODUCTION THEREOF KURARAY CO., LTD. (JP) 1985-07-24 EP disclosed
EP-0054753-A1 Polyprenyl composition or compounds and process for the production thereof KURARAY CO., LTD. (JP) 1982-06-30 EP disclosed