SCHEMBL8301498

SCHEMBL8301498

On1nncc1-c1ccccc1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.45
LMNA P02545 2/20 0.40
EGLN2 Q96KS0 1/20 0.39
NPC1 O15118 4/20 0.39
RAB9A P51151 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
ALDH1A1 P00352 3/20 0.39
HSD11B1 P28845 1/20 0.39
IDO1 P14902 1/20 0.38
CYP2A6 P11509 1/20 0.38
HPGD P15428 2/20 0.37
TP53 P04637 1/20 0.37
NOTUM Q6P988 1/20 0.37
ATM Q13315 1/20 0.37
KMT2A Q03164 4/20 0.36
POLB P06746 1/20 0.36
KDM4E B2RXH2 2/20 0.35
GPR55 Q9Y2T6 1/20 0.35
MEN1 O00255 2/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL27953930 0.73 P2RX7 (0.81) P2RX7LMNANPC1RAB9ASMN1; SMN2
SCHEMBL8947126 0.69 P2RX7 (0.47) P2RX7LMNANPC1RAB9ASMN1; SMN2
SCHEMBL22428016 0.66 KMT2A (0.40) LMNAEGLN2NPC1RAB9ASMN1; SMN2
SCHEMBL29883244 0.64 CYP2A6 (0.67) LMNANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL671133 0.64 CYP2A6 (0.67) LMNANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL29802156 0.64 CYP2A6 (0.67) LMNANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL23928715 0.64
SCHEMBL18015441 0.64 LDHA (0.54) LMNANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL27646280 0.63 CYP2A6 (0.52) LMNANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL3031317 0.62 DYRK1A (0.57) EGLN2SMN1; SMN2ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5998446-A INSECTICIDE; MITICIDE; NEMATOCIDE BASF AKTIENGESELLSCHAFT (DE) 1999-12-07 US disclosed
EP-0812317-B1 2-[2-(HETARYL OXYMETHYLENE)PHENYL] CROTONATES USED AS PESTICIDES AND FUNGICIDES BASF AG (DE) 1999-09-08 EP disclosed
EP-0812317-A1 2- 2-(HETARYL OXYMETHYLENE)PHENYL] CROTONATES USED AS PESTICIDES AND FUNGICIDES BASF AKTIENGESELLSCHAFT (DE) 1997-12-17 EP disclosed
WO-1996037480-A1 2-[2-(HETARYL OXYMETHYLENE)PHENYL] CROTONATES USED AS PESTICIDES AND FUNGICIDES BASF AKTIENGESELLSCHAFT (DE) 1996-11-28 WO disclosed