SCHEMBL9874346

SCHEMBL9874346

O=C(/C=C/c1ccc(-c2nc(C(Cl)(Cl)Cl)nc(C(Cl)(Cl)Cl)n2)cc1)Oc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.50
HTR1A P08908 1/20 0.45
MAOB P27338 2/20 0.41
MEN1 O00255 3/20 0.40
LMNA P02545 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 2/20 0.39
SRD5A2 P31213 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
RAD51 Q06609 1/20 0.38
MGLL Q99685 1/20 0.38
HDAC2 Q92769 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
SCHEMBL9874348 1.00 KMT2A (0.50) KMT2AHTR1AMAOBMEN1LMNA
SCHEMBL9462232 0.83 CA12 (0.51) KMT2AHTTSMN1; SMN2ALDH1A1MAPT
SCHEMBL9462236 0.83 CA12 (0.51) KMT2AHTTSMN1; SMN2ALDH1A1MAPT
SCHEMBL9871321 0.83 ESR1 (0.46) KMT2AMEN1LMNASMN1; SMN2ALDH1A1
SCHEMBL9871317 0.83 ESR1 (0.46) KMT2AMEN1LMNASMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL9462388 0.81 ESR1 (0.45) KMT2AMEN1LMNASMN1; SMN2ALDH1A1
SCHEMBL126667 0.80 PARP10 (0.45) KMT2AMEN1L3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL9874060 0.80 CA12 (0.55) MAOBLMNAL3MBTL1NPSR1SMN1; SMN2
SCHEMBL9874052 0.80 CA12 (0.55) MAOBLMNAL3MBTL1NPSR1SMN1; SMN2
SCHEMBL9462342 0.80 HDAC2 (0.36) MAOBMAPTHDAC2

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-5064959-A Photoinitiators HOECHST AKTIENGESELLSCHAFT (DE) 1991-11-12 US disclosed