SCHEMBL5161609

SCHEMBL5161609

O=C1Cc2ccc(-c3ccccc3)cc2C1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.56
TDP2 O95551 7/20 0.56
CFTR P13569 1/20 0.50
GOPC Q9HD26 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP11B1 P15538 1/20 0.50
CYP11B2 P19099 1/20 0.50
CYP2C19 P33261 1/20 0.50
TYRO3 Q06418 2/20 0.49
NTRK2 Q16620 2/20 0.49
CLK4 Q9HAZ1 2/20 0.49
DYRK1B Q9Y463 2/20 0.49
PARP10 Q53GL7 1/20 0.46
PARP11 Q9NR21 1/20 0.46
CYP2A6 P11509 1/20 0.43
MEN1 O00255 1/20 0.42
APAF1 O14727 1/20 0.42
NPC1 O15118 1/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL27806355 0.86 CYP2A6 (0.59) CYP1A2TDP2CFTRGOPCCYP3A4
SCHEMBL4970944 0.86 CYP1A2 (0.67) CYP1A2TDP2CFTRGOPCCYP3A4
SCHEMBL5713325 0.85 TDP2 (0.52) CYP1A2TDP2TYRO3NTRK2CLK4
SCHEMBL9288568 0.81 PARP10 (0.51) CYP1A2TDP2CYP3A4CYP2C9CYP11B1
SCHEMBL25405402 0.77 CLK4 (0.60) CYP1A2TDP2CYP11B1CYP11B2TYRO3
SCHEMBL25451009 0.77 RXRA (0.50) CYP1A2TDP2CYP3A4CYP2C9CYP11B1
SCHEMBL29569358 0.76 TDP2 (0.61) TDP2TYRO3NTRK2CLK4DYRK1B
SCHEMBL3136254 0.76 TDP2 (0.61) TDP2TYRO3NTRK2CLK4DYRK1B
SCHEMBL1482920 0.76 TDP2 (0.61) TDP2TYRO3NTRK2CLK4DYRK1B
SCHEMBL30831157 0.74 TDP2 (0.59) TDP2TYRO3NTRK2CLK4DYRK1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1153944-B1 PROPYLENE POLYMER, MOLDED OBJECT THEREOF IDEMITSU KOSAN CO (JP) 2007-01-31 EP disclosed
US-6800706-B1 TRANSPARENT, LOW-TEMPERATURE HEAT-SEALABILITY AND WEAR RESISTANCE; WRAPPING AND PACKAGING FILMS IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2004-10-05 US disclosed
EP-1153944-A1 PROPYLENE POLYMER, MOLDED OBJECT THEREOF, AND PROCESS FOR PRODUCING PROPYLENE POLYMER IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2001-11-14 EP disclosed