SCHEMBL12379568

SCHEMBL12379568

CCCCCCc1ccc2c(-c3ccc(N(C)c4ccc(CCCC)cc4)cc3)c3ccccc3c(-c3ccc(C)cc3)c2c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSV O60911 2/20 0.41
CTSL P07711 2/20 0.41
HSD11B1 P28845 2/20 0.39
RORA P35398 1/20 0.38
RORC P51449 1/20 0.38
RORB Q92753 1/20 0.38
CNR2 P34972 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
ATM Q13315 1/20 0.37
MAPK8 P45983 1/20 0.36
RARB P10826 1/20 0.36
KCNH2 Q12809 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
STAT3 P40763 1/20 0.36
GPR3 P46089 1/20 0.36
DHODH Q02127 1/20 0.35

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
SCHEMBL12379518 0.91 MLNR (0.38) CTSVCTSLHSD11B1RORARORC
SCHEMBL12379542 0.87 LPL (0.39) CTSVCTSLHSD11B1RORARORC
SCHEMBL12619459 0.81 HSD17B10 (0.51) HSD11B1NPC1RAB9AATMRARB
SCHEMBL12379553 0.81 HSD17B10 (0.51) HSD11B1NPC1RAB9AATMRARB
SCHEMBL12619731 0.79 HSD11B1 (0.48) HSD11B1CNR2NPC1RAB9AATM
SCHEMBL12619749 0.79 HSD11B1 (0.51) HSD11B1CNR2NPC1RAB9AATM
SCHEMBL12619649 0.79 HSD17B10 (0.49) HSD11B1NPC1RAB9AATMRARB
SCHEMBL19422233 0.79 HSD17B10 (0.49) HSD11B1NPC1RAB9AATMRARB
SCHEMBL12379561 0.79 RARB (0.44) CTSVCTSLHSD11B1NPC1RAB9A
SCHEMBL5371426 0.79 HSD11B1 (0.48) CTSVCTSLHSD11B1RORARORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110198573-A1 CHARGE-TRANSPORTING POLYMER, COMPOSITION FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC EL DISPLAY, AND ORGANIC EL LIGHTING MITSUBISHI CHEMICAL CORPORATION (JP) 2011-08-18 US disclosed