SCHEMBL7740492

SCHEMBL7740492

Cc1ccccc1-c1cccc(C)c1N(c1ccccc1C)P(=O)(O)O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.33
NR1H4 Q96RI1 1/20 0.32
HSD17B1 P14061 1/20 0.32
LMNA P02545 2/20 0.32
CYP3A4 P08684 3/20 0.32
S1PR4 O95977 1/20 0.32
APAF1 O14727 1/20 0.32
NPC1 O15118 1/20 0.32
TDP2 O95551 1/20 0.32
NSD2 O96028 1/20 0.32
CYP1A2 P05177 1/20 0.32
MAPT P10636 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
CASP3 P42574 1/20 0.32
RAB9A P51151 1/20 0.32
BLM P54132 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SENP8 Q96LD8 1/20 0.32
NLRP3 Q96P20 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
SCHEMBL7740415 0.85 GPBAR1 (0.35) HSD17B1LMNACYP3A4APAF1NPC1
SCHEMBL28562906 0.82 GPBAR1 (0.37) MYCBRD4ACP3GPBAR1HPGD
SCHEMBL8365536 0.75 ALDH1A1 (0.39) CYP1A2MAPTACP3HPGD
SCHEMBL2847873 0.70 GPBAR1 (0.35) HSD17B1LMNAGPBAR1HPGD
Phosphoric Acid SCHEMBL28782897 0.69 TRPA1 (0.41) MYCLMNACYP3A4NPC1CYP1A2
SCHEMBL22781053 0.67 ACHE (0.43) HSD17B1LMNACYP3A4CYP1A2TRPM8
Piperazine SCHEMBL329108 0.67 ADRB1 (0.39) CYP3A4CYP1A2CYP2C9HTR7HPGD
Phosphoric Acid SCHEMBL29061092 0.66 MYC (0.55) MYCNPC1MAPTCASP3RAB9A
SCHEMBL598761 0.64 TSHR (0.53) MYCNPC1CYP1A2CASP3RAB9A
SCHEMBL197690 0.64 ACHE (0.64) CYP3A4NPC1CYP1A2CASP3RAB9A

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
US-6414060-B1 ADDITION-CONDENSATION COPOLYMER ALBEMARLE CORPORATION 2002-07-02 US disclosed
EP-1067153-A1 Flame retardant polycarbonate-ABS polymer compositions ALBEMARLE CORPORATION (US) 2001-01-10 EP disclosed