SCHEMBL28113028

SCHEMBL28113028

CCC(C)(C)Pc1c2ccccc2cc2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.38
HTR2A P28223 1/20 0.38
ALDH1A1 P00352 4/20 0.34
HSD17B10 Q99714 3/20 0.34
HIF1A Q16665 1/20 0.34
CYP1B1 Q16678 1/20 0.34
CYP1A2 P05177 4/20 0.34
CYP2A6 P11509 1/20 0.34
HPGD P15428 2/20 0.34
KDM4E B2RXH2 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
GLA P06280 1/20 0.33
CYP2C19 P33261 1/20 0.33
NR1I2 O75469 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
CYP3A4 P08684 1/20 0.32
ERBB2 P04626 1/20 0.32
FYN P06241 1/20 0.32

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
SCHEMBL28112951 0.79 TRPM4 (0.37) L3MBTL1HTR2AALDH1A1HSD17B10HIF1A
SCHEMBL27908453 0.74 ALDH1A1 (0.38) HTR2AALDH1A1HSD17B10CYP1A2CYP2A6
SCHEMBL27891536 0.70 CYP2A6 (0.42) L3MBTL1HTR2AALDH1A1HSD17B10HIF1A
SCHEMBL23289813 0.68 ALDH1A1 (0.48) L3MBTL1HTR2AALDH1A1HSD17B10HIF1A
SCHEMBL2547962 0.68 HTR2A (0.39) L3MBTL1HTR2AALDH1A1HSD17B10HIF1A
SCHEMBL28112966 0.67 TAAR1 (0.38) ALDH1A1MEN1KMT2AMAPK1CYP3A4
SCHEMBL17993330 0.67 MEN1 (0.40) L3MBTL1HTR2AALDH1A1HSD17B10HIF1A
SCHEMBL20268353 0.65 HTR2A (0.41) L3MBTL1HTR2AALDH1A1HSD17B10HIF1A
Propane SCHEMBL243407 0.65 PTPN22 (0.50) L3MBTL1HTR2AALDH1A1HSD17B10HIF1A
SCHEMBL30992096 0.65 HTR2A (0.60) L3MBTL1HTR2AALDH1A1HSD17B10HIF1A

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-102947319-B Method and tertiary phosphine for phosphine oxides is reduced into corresponding tertiary phosphine in the presence of a catalyst is used for reducing in the presence of a catalyst the purposes of phosphine oxides 克罗马福拉公司 2016-11-09 CN disclosed
CN-102947319-A A process for the reduction of a tertiary phosphine oxide to the corresponding tertiary phosphine in the presence of a catalyst and use of a tertiary phosphine for reducing a tertiary phosphine oxide in the presence of a catalyst CHROMAFORA AB 2013-02-27 CN disclosed