SCHEMBL14804380

SCHEMBL14804380

Cc1ccc(-c2ccc(-c3ccc(C)cn3)nc2)nc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.76
CCR5 P51681 1/20 0.76
CCR8 P51685 1/20 0.76
HDAC6 Q9UBN7 1/20 0.76
CYP3A4 P08684 1/20 0.62
CYP2A6 P11509 1/20 0.62
METAP2 P50579 1/20 0.53
PTGS2 P35354 2/20 0.45
KDM1A O60341 1/20 0.44
NOS3 P29474 1/20 0.44
NOS2 P35228 1/20 0.44
GRIA2 P42262 1/20 0.43
GRM5 P41594 2/20 0.42
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
KMT2A Q03164 1/20 0.39
PIM1 P11309 2/20 0.39
AURKA O14965 1/20 0.39

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
SCHEMBL17051522 0.93 CCR1 (0.65) CCR1CCR5CCR8HDAC6CYP3A4
SCHEMBL17051514 0.90 CCR1 (0.75) CCR1CCR5CCR8HDAC6CYP3A4
SCHEMBL3426229 0.89 CYP3A4 (0.61) CCR1CCR5CCR8HDAC6CYP3A4
SCHEMBL17051547 0.89 CCR1 (0.60) CCR1CCR5CCR8HDAC6CYP3A4
SCHEMBL14804374 0.88 CCR1 (0.73) CCR1CCR5CCR8HDAC6CYP3A4
SCHEMBL17051556 0.88 CCR1 (0.59) CCR1CCR5CCR8HDAC6CYP3A4
SCHEMBL2477927 0.88 CCR1 (0.71) CCR1CCR5CCR8HDAC6CYP3A4
SCHEMBL17051557 0.87 CCR1 (0.58) CCR1CCR5CCR8HDAC6CYP3A4
SCHEMBL15614084 0.87 CYP3A4 (0.65) CCR1CCR5CCR8HDAC6CYP3A4
Abametapir SCHEMBL351152 0.87 CCR1 (1.00) CCR1CCR5CCR8HDAC6CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8981354-B2 Organic light-emitting polymer and device CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2015-03-17 US disclosed
US-8981354-B2 Organic light-emitting polymer and device CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2015-03-17 US disclosed
US-20130299787-A1 ORGANIC LIGHT-EMITTING DEVICE AND METHOD SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2013-11-14 US disclosed
US-20130299787-A1 ORGANIC LIGHT-EMITTING DEVICE AND METHOD SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2013-11-14 US disclosed
US-20130146852-A1 ORGANIC LIGHT-EMITTING POLYMER AND DEVICE SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2013-06-13 US disclosed
US-20130146852-A1 ORGANIC LIGHT-EMITTING POLYMER AND DEVICE SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2013-06-13 US disclosed
US-20130075714-A1 POLYMER, POLYMER COMPOSITION AND ORGANIC LIGHT-EMITTING DEVICE SUMTOMO CHEMICAL COMPANY LIMITED (JP) 2013-03-28 US disclosed
US-20130075714-A1 POLYMER, POLYMER COMPOSITION AND ORGANIC LIGHT-EMITTING DEVICE SUMTOMO CHEMICAL COMPANY LIMITED (JP) 2013-03-28 US disclosed