SCHEMBL11308570

SCHEMBL11308570

Cc1cc(O[C]=O)ccc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.50
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
PKM P14618 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.42
NPC1 O15118 3/20 0.42
ALDH1A1 P00352 3/20 0.42
RAB9A P51151 2/20 0.42
KDM4E B2RXH2 2/20 0.41
POLB P06746 2/20 0.41
MRGPRX4 Q96LA9 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
SENP2 Q9HC62 1/20 0.39
GAA P10253 2/20 0.39
HTR2A P28223 1/20 0.39
SLC6A4 P31645 1/20 0.39
KCNH2 Q12809 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL95604 0.81 HSP90AA1 (0.44) KMT2AMEN1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL8611735 0.81 TDP1 (0.46) KMT2AMEN1SMN1; SMN2NPC1ALDH1A1
SCHEMBL16939067 0.80 MCL1 (0.46) MCL1KMT2AMEN1PKMSMN1; SMN2
SCHEMBL6564428 0.76 KDM4E (0.56) MCL1KMT2AMEN1PKMSMN1; SMN2
SCHEMBL2091614 0.76 PPARG (0.42) KMT2AALDH1A1TDP1HTR2ASLC6A4
SCHEMBL2090043 0.76 HTR2A (0.38) KMT2ASMN1; SMN2RAB9AHTR2ASLC6A4
SCHEMBL130126 0.74 MCL1 (0.52) MCL1KMT2AMEN1PKMSMN1; SMN2
SCHEMBL10528819 0.73 CYP11B1 (0.36) KMT2AMEN1NPC1RAB9AKDM4E
SCHEMBL2089132 0.73 CA12 (0.41) KMT2AMEN1PKMSMN1; SMN2NPC1
SCHEMBL3757525 0.72 MCL1 (0.50) MCL1KMT2AMEN1PKMSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4259350-A PROTECTING DEGRADABLE ORGANIC MATERIAL FROM FUNGAL OR INSECT ATTACK SANKYO COMPANY LIMITED (JP) 1981-03-31 US disclosed