SCHEMBL7919260

SCHEMBL7919260

C=[Ti](OC(=O)c1cccc2ccccc12)(OC(=O)c1cccc2ccccc12)(C1=CC=CC1)C1c2ccccc2-c2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.37
MEN1 O00255 6/20 0.37
ALDH1A1 P00352 5/20 0.37
HPGD P15428 5/20 0.37
MAPT P10636 4/20 0.37
LMNA P02545 3/20 0.37
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2D6 P10635 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 1/20 0.37
KCNH2 Q12809 1/20 0.37
POLB P06746 3/20 0.35
GAA P10253 1/20 0.35
CDC25B P30305 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
NR4A1 P22736 1/20 0.33
NR4A2 P43354 1/20 0.33
NR4A3 Q92570 1/20 0.33
PLK1 P53350 1/20 0.33

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
SCHEMBL7928620 0.86 KMT2A (0.36) KMT2AMEN1ALDH1A1HPGDMAPT
SCHEMBL7925562 0.83 KMT2A (0.32) KMT2AMEN1ALDH1A1HPGDMAPT
SCHEMBL7927145 0.83 KMT2A (0.42) KMT2AMEN1ALDH1A1HPGDMAPT
SCHEMBL7923901 0.82 KMT2A (0.33) KMT2AMEN1ALDH1A1HPGDLMNA
SCHEMBL7927103 0.81 POLB (0.41) KMT2AMEN1LMNAPOLBGAA
SCHEMBL7919194 0.79 LMNA (0.33) KMT2AALDH1A1LMNACYP1A2CYP3A4
SCHEMBL7925865 0.78 POLB (0.33) MAPTCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL7930752 0.78 MAPT (0.34) KMT2AMEN1MAPTLMNAPOLB
SCHEMBL7927134 0.78 POLB (0.35) POLB
SCHEMBL7928341 0.78 POLB (0.33) ALDH1A1MAPTLMNAPOLBNPSR1

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-0867454-B1 POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING POLYMERS IDEMITSU KOSAN CO (JP) 2001-03-21 EP disclosed
US-6075102-A Polymerization catalyst and process for producing polymers IDEMITSU KOSAN CO., LTD. (JP) 2000-06-13 US disclosed
EP-0867454-A1 POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING POLYMERS IDEMITSU KOSAN COMPANY LIMITED (JP) 1998-09-30 EP disclosed