SCHEMBL28116434

SCHEMBL28116434

Cc1ccccc1-c1ccccc1C(=O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 2/20 0.53
MAPK14 Q16539 2/20 0.52
MYC P01106 2/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 1/20 0.50
CYP2C8 P10632 1/20 0.50
CYP2C9 P11712 1/20 0.50
ALDH1A1 P00352 3/20 0.48
POLB P06746 1/20 0.46
NPSR1 Q6W5P4 1/20 0.45
KMT2A Q03164 1/20 0.45
TUBB4A P04350 1/20 0.44
TUBB P07437 1/20 0.44
TUBA3C P0DPH7 1/20 0.44
TUBA1B P68363 1/20 0.44
TUBA4A P68366 1/20 0.44
TUBB4B P68371 1/20 0.44
TUBB3 Q13509 1/20 0.44
TUBB2A Q13885 1/20 0.44
TUBB8 Q3ZCM7 1/20 0.44

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
SCHEMBL934811 0.88 AKR1C3 (0.67) AKR1C3GAAMAPTCYP2C8CYP2C9
SCHEMBL9451511 0.84 AKR1C3 (0.61) AKR1C3MAPK14GAAMAPTALDH1A1
Benzene SCHEMBL27600962 0.84 AKR1C3 (0.61) AKR1C3MAPK14GAAMAPTALDH1A1
SCHEMBL29402362 0.84 AKR1C3 (0.61) AKR1C3MAPK14GAAMAPTALDH1A1
SCHEMBL236 0.84 AKR1C3 (0.61) AKR1C3MAPK14GAAMAPTALDH1A1
SCHEMBL11082147 0.83 CYP2C8 (0.54) MAPK14MAPTCYP2C8CYP2C9ALDH1A1
SCHEMBL981886 0.83 CES2 (0.52) MAPK14MYCPOLB
SCHEMBL28012737 0.82 AKR1C3 (0.55) AKR1C3GAAMAPTCYP2C8CYP2C9
SCHEMBL27394435 0.82 CYP2C8 (0.49) AKR1C3MAPK14MYCGAAMAPT
SCHEMBL656 0.82 MYC (0.71) AKR1C3MYCGAACYP2C9ALDH1A1

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-106547168-B Black matrix material composition and application 深圳市华星光电技术有限公司 2020-09-01 CN disclosed
CN-106547168-A A kind of black-matrix material compositionss and application 深圳市华星光电技术有限公司 2017-03-29 CN disclosed