SCHEMBL5853877

SCHEMBL5853877

Cc1ccccc1C(=O)N[Hf](Cl)(Cl)(C1C=Cc2ccccc21)[SiH](C)C

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.36
FLT1 P17948 1/20 0.36
FLT4 P35916 1/20 0.36
KDR P35968 1/20 0.36
NPC1 O15118 5/20 0.35
RAB9A P51151 5/20 0.35
ALOX15 P16050 1/20 0.35
HTT P42858 1/20 0.35
KCNMA1 Q12791 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
DHODH Q02127 1/20 0.34
ALDH1A1 P00352 2/20 0.33
POLB P06746 2/20 0.33
TYK2 P29597 1/20 0.33
MAPK1 P28482 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
P2RX7 Q99572 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
SCHEMBL5852863 0.88 TAS1R3 (0.36) NPC1RAB9AL3MBTL1
SCHEMBL5853111 0.88 HPGD (0.36) HPGDFLT1FLT4KDRNPC1
SCHEMBL5853411 0.86 KCNK3 (0.33) ALDH1A1
SCHEMBL5854713 0.85 ITGB1 (0.30)
SCHEMBL5853982 0.84 MEN1 (0.33) NPC1RAB9AALOX15HTTSMN1; SMN2
SCHEMBL5853551 0.84 KMT2A (0.34) NPC1RAB9AHTTSMN1; SMN2
SCHEMBL5856905 0.83 POLB (0.33) KDRNPC1RAB9APOLB
SCHEMBL5854290 0.83
SCHEMBL5852864 0.81 SMN1; SMN2 (0.41) NPC1RAB9ASMN1; SMN2POLBL3MBTL1
SCHEMBL5852586 0.80 SMN1; SMN2 (0.31) ALOX15SMN1; SMN2MAPK1

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
US-7037989-B2 Copolymers of ethylene and/or α-olefins and vicinally disubstituted olefins EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-05-02 US disclosed
WO-2004106394-A1 COPOLYMERS OF ETHYLENE AND/OR α-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-12-09 WO disclosed
US-20040242814-A1 COPOLYMERS OF ETHYLENE AND/OR ALPHA-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-02 US disclosed