SCHEMBL7925610

SCHEMBL7925610

CCC(=O)O[Ti](OC(=O)CC)(OC(=O)CC)C1C=Cc2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 2/20 0.37
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ELANE P08246 1/20 0.32
POLB P06746 2/20 0.32
HTR6 P50406 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
MAPK1 P28482 1/20 0.31
HSD17B10 Q99714 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
HTR2A P28223 1/20 0.31
SIGMAR1 Q99720 2/20 0.31
CYP1A2 P05177 1/20 0.30
P2RX1 P51575 1/20 0.30
P2RX3 P56373 1/20 0.30
P2RX4 Q99571 1/20 0.30

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
SCHEMBL7927256 0.89 RET (0.36) RETLMNASMN1; SMN2MEN1KMT2A
SCHEMBL7931030 0.88 RET (0.37) RETLMNASMN1; SMN2ELANEPOLB
SCHEMBL7919128 0.83 POLB (0.41) RETLMNASMN1; SMN2MEN1KMT2A
SCHEMBL7925544 0.79 ELANE (0.33) LMNAMEN1KMT2AELANEPOLB
SCHEMBL7928317 0.78 POLB (0.34) MEN1KMT2AELANEPOLB
SCHEMBL7928436 0.78 LMNA (0.39) LMNASMN1; SMN2MEN1KMT2APOLB
SCHEMBL7919512 0.77 RET (0.36) RETLMNASMN1; SMN2POLBHTR6
SCHEMBL6273664 0.77 RET (0.39) RETLMNASMN1; SMN2MEN1KMT2A
SCHEMBL7919144 0.77 ATM (0.31)
SCHEMBL7925031 0.77 THRB (0.32) HTR6

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