SCHEMBL24947728

SCHEMBL24947728

CCc1c(Cl)cccc1NC

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.39
KMT2A Q03164 3/20 0.39
POLB P06746 3/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.38
CDK5 Q00535 1/20 0.37
CDK5R1 Q15078 1/20 0.37
LMNA P02545 2/20 0.37
AKR1B1 P15121 1/20 0.36
MEN1 O00255 2/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
HTT P42858 2/20 0.36
PKM P14618 1/20 0.36
GLA P06280 1/20 0.35
NPSR1 Q6W5P4 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
SCHEMBL16938171 0.84 MAPT (0.41) POLBKDM4EALDH1A1SMN1; SMN2HTT
SCHEMBL9232504 0.82 KMT2A (0.41) TAAR1KMT2AKDM4EALDH1A1LMNA
SCHEMBL10310076 0.81 MAPT (0.40) TAAR1POLBKDM4EALDH1A1LMNA
Hydrochloric Acid SCHEMBL9561632 0.80 TAAR1 (0.41) TAAR1KMT2APOLBKDM4EALDH1A1
SCHEMBL91356 0.79 TAAR1 (0.50) TAAR1KMT2APOLBKDM4EALDH1A1
SCHEMBL23341283 0.77 MAPT (0.47) TAAR1KMT2APOLBKDM4EALDH1A1
SCHEMBL5436495 0.77 KCNH2 (0.46) TAAR1POLBKDM4EALDH1A1SMN1; SMN2
SCHEMBL9608995 0.76 PKM (0.57) KMT2APOLBKDM4EALDH1A1LMNA
SCHEMBL26027491 0.76 HTT (0.41) KMT2APOLBKDM4EALDH1A1LMNA
SCHEMBL24603808 0.75 PSIP1 (0.40) TAAR1KMT2APOLBKDM4EALDH1A1

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
EP-4122937-A1 POLYCYCLIC AROMATIC COMPOUND AND ORGANOELECTROLUMINESCENT DEVICE USING SAME SFC Co., Ltd. (KR) 2023-01-25 EP disclosed