SCHEMBL28612978

SCHEMBL28612978

Cc1cc(C)c(C(=O)Cl)c(C)c1.O=P

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 3/20 0.40
TAS1R1 Q7RTX1 3/20 0.40
TAS1R2 Q8TE23 3/20 0.40
KMT2A Q03164 3/20 0.39
HPGD P15428 2/20 0.39
KDM4E B2RXH2 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MCOLN3 Q8TDD5 1/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPK1 P28482 2/20 0.38
TPMT P51580 1/20 0.37
MAPT P10636 1/20 0.37
POLB P06746 1/20 0.36
HTT P42858 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL246394 0.97 TAS1R3 (0.41) TAS1R3TAS1R1TAS1R2KMT2AHPGD
Phosphine SCHEMBL27814958 0.95 TAS1R3 (0.40) TAS1R3TAS1R1TAS1R2KMT2AHPGD
SCHEMBL28501367 0.84 KDM4E (0.44) TAS1R3TAS1R1TAS1R2KMT2AHPGD
SCHEMBL18033973 0.84 HTT (0.44) TAS1R3TAS1R1TAS1R2KMT2AHPGD
SCHEMBL4355570 0.82 CA1 (0.43) KMT2AHPGDSMN1; SMN2MEN1LMNA
SCHEMBL2154502 0.80 ALDH1A1 (0.38) KMT2AHPGDSMN1; SMN2MEN1LMNA
SCHEMBL21870 0.79 KDM4E (0.55) TAS1R3TAS1R1TAS1R2KMT2AHPGD
SCHEMBL377596 0.79 KDM4E (0.55) TAS1R3TAS1R1TAS1R2KMT2AHPGD
SCHEMBL11452025 0.79 ALDH1A1 (0.36) TAS1R3TAS1R1TAS1R2KMT2AHPGD
SCHEMBL7531729 0.79 KMT2A (0.38) TAS1R3TAS1R1TAS1R2KMT2AHPGD

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
CN-113136008-A High-precision 3D printing light-cured resin 深圳光华伟业股份有限公司 2021-07-20 CN disclosed