SCHEMBL6267429

SCHEMBL6267429

Cc1ccc2c(n1)c1ccc(C)nc1c1ccc(C)nc21

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 2/20 0.63
RAB9A P51151 1/20 0.63
CCR5 P51681 1/20 0.63
KMT2A Q03164 2/20 0.54
OPRK1 P41145 1/20 0.54
MAPT P10636 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
CYP1A2 P05177 2/20 0.46
METAP2 P50579 1/20 0.44
CTSB P07858 1/20 0.42
CTSH P09668 1/20 0.42
GAA P10253 1/20 0.41
ADORA1 P30542 4/20 0.40
ADORA2A P29274 3/20 0.40
CCR8 P51685 1/20 0.39
PARP1 P09874 1/20 0.38

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
SCHEMBL3786280 0.89 CCR1 (0.52) CCR1RAB9ACCR5KMT2AOPRK1
SCHEMBL30608515 0.87 CCR1 (0.50) CCR1RAB9ACCR5KMT2AOPRK1
SCHEMBL12258321 0.82 CCR1 (0.57) CCR1RAB9ACCR5KMT2AOPRK1
SCHEMBL10372511 0.82 CYP1A2 (0.54) CCR1RAB9ACCR5KMT2AOPRK1
SCHEMBL17612277 0.82 CCR1 (0.50) CCR1RAB9ACCR5KMT2AOPRK1
SCHEMBL21959272 0.80 L3MBTL1 (0.57) CCR1RAB9ACCR5KMT2AOPRK1
SCHEMBL20313299 0.78 MAOA (0.50) CCR1RAB9ACCR5KMT2AOPRK1
SCHEMBL17532743 0.78 GPR3 (0.59) CCR1RAB9ACCR5MAPTL3MBTL1
SCHEMBL31186674 0.78 KMT2A (0.69) CCR1RAB9ACCR5KMT2AOPRK1
SCHEMBL6177657 0.78 KMT2A (0.69) CCR1RAB9ACCR5KMT2AOPRK1

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
WO-2005042613-A1 MULTIFUNCTIONAL MONOMERS CONTAINING BOUND MESOGENIC PORAGEN FORMING MOIETIES AND POLYARYLENE COMPOSITIONS THEREFROM DOW GLOBAL TECHNOLOGIES INC. (US) 2005-05-12 WO disclosed