SCHEMBL10436722

SCHEMBL10436722

Cc1ccc2c(n1)c(C)c(C)c1c(C)c(C)c(C)nc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.41
RAB9A P51151 1/20 0.41
CCR5 P51681 1/20 0.41
KMT2A Q03164 3/20 0.39
OPRK1 P41145 1/20 0.39
MAPT P10636 2/20 0.36
GAA P10253 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CTSB P07858 1/20 0.33
CTSH P09668 1/20 0.33
METAP2 P50579 1/20 0.32
CYP1A2 P05177 1/20 0.32
LMNA P02545 1/20 0.31
KDM4E B2RXH2 2/20 0.31
MAPK1 P28482 1/20 0.30
ADORA2A P29274 1/20 0.30

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
SCHEMBL6267429 0.73 CCR1 (0.63) CCR1RAB9ACCR5KMT2AOPRK1
SCHEMBL77350 0.71 IDO1 (0.37)
SCHEMBL11976534 0.71 IDO1 (0.39)
SCHEMBL12258321 0.69 CCR1 (0.57) CCR1RAB9ACCR5KMT2AOPRK1
SCHEMBL10884002 0.69 SMN1; SMN2 (0.50) CCR1RAB9ACCR5KMT2AOPRK1
SCHEMBL31290662 0.69 SMN1; SMN2 (0.50) CCR1RAB9ACCR5KMT2AOPRK1
SCHEMBL862535 0.68 GAA (0.40) GAASMN1; SMN2L3MBTL1HTTTDP1
SCHEMBL31005824 0.68 KMT2A (0.50) CCR1RAB9ACCR5KMT2AOPRK1
SCHEMBL31005825 0.68 CCR1 (0.44) CCR1RAB9ACCR5KMT2AOPRK1
SCHEMBL6266381 0.67 L3MBTL1 (0.52) CCR1CCR5KMT2AOPRK1MAPT

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
EP-0369864-A2 Process for producing aromatic amines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-05-23 EP disclosed