SCHEMBL7928616

SCHEMBL7928616

O=C(O[Ti](OC(=O)C1CCCCC1)(OC(=O)C1CCCCC1)C1=CC=CC1)C1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.36
NPC1 O15118 2/20 0.36
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
MIF P14174 2/20 0.35
KMT2A Q03164 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ATM Q13315 1/20 0.35
RBBP9 O75884 1/20 0.35
POLB P06746 2/20 0.34
ELANE P08246 1/20 0.33
PKM P14618 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 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
SCHEMBL7927346 0.72
SCHEMBL7928618 0.70 HIF1A (0.33) KMT2ASMN1; SMN2ESR1
SCHEMBL7928427 0.68 ALDH1A1 (0.36) KMT2A
SCHEMBL7927774 0.67 CES2 (0.48) RAB9AMIFKMT2ASMN1; SMN2HTT
SCHEMBL7927186 0.66 ALDH1A1 (0.34) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL7924767 0.65 ALDH1A1 (0.33) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL7930864 0.65 POLB (0.33) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL7925138 0.64
SCHEMBL4370896 0.63
SCHEMBL2198986 0.62 CES2 (0.58) MIFKMT2ASMN1; SMN2HTTTDP1

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