SCHEMBL30078552

SCHEMBL30078552

CC#Cc1ccc(C)cn1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 2/20 0.46
CCR5 P51681 2/20 0.46
CCR8 P51685 2/20 0.46
HDAC6 Q9UBN7 1/20 0.46
GRM5 P41594 3/20 0.44
NOS3 P29474 1/20 0.43
NOS2 P35228 1/20 0.43
ADRA2A P08913 3/20 0.39
ADRA2B P18089 3/20 0.39
ADRA2C P18825 3/20 0.39
PLAU P00749 1/20 0.39
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
METAP2 P50579 1/20 0.34
SRC P12931 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2A6 P11509 1/20 0.33
BTK Q06187 1/20 0.32
DOT1L Q8TEK3 1/20 0.31

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
SCHEMBL12295342 1.00 CCR1 (0.46) CCR1CCR5CCR8HDAC6GRM5
SCHEMBL10140986 0.80 CCR1 (0.44) CCR1CCR5CCR8HDAC6GRM5
SCHEMBL16289566 0.80 CCR1 (0.44) CCR1CCR5CCR8HDAC6GRM5
SCHEMBL14129682 0.78 GRM5 (0.53) CCR1CCR5CCR8HDAC6GRM5
SCHEMBL3958689 0.78 CCR1 (0.43) CCR1CCR5CCR8HDAC6GRM5
SCHEMBL22270434 0.77 ADRA2A (0.41) GRM5ADRA2AADRA2BADRA2CMAPT
SCHEMBL5740851 0.77 MAPT (0.41) GRM5MAPTCYP2A6
SCHEMBL3090594 0.76
SCHEMBL17039215 0.76 GRM5 (0.54) GRM5BTK
SCHEMBL15991273 0.76 ADRA2A (0.38) GRM5ADRA2AADRA2BADRA2CPLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115052860-B Collagen 1 translation inhibitors and methods of use thereof 艾尼莫生物科技公司 2024-06-21 CN disclosed
CN-115052860-A Collagen 1 translation inhibitors and methods of use thereof 艾尼莫生物科技公司 2022-09-13 CN disclosed