SCHEMBL24169983

SCHEMBL24169983

C=CCCN1CCc2cc(Cl)ccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
APOBEC3A P31941 2/20 0.41
APOBEC3G Q9HC16 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALPL P05186 1/20 0.41
ALPI P09923 1/20 0.41
MAPT P10636 1/20 0.41
ALPG P10696 1/20 0.41
MAPK1 P28482 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 2/20 0.41
USP2 O75604 1/20 0.41
CDK4 P11802 1/20 0.41
ALOX15 P16050 1/20 0.41
CCND1 P24385 1/20 0.41

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
SCHEMBL24169494 0.85 NOTUM (0.47) NOTUMMEN1KMT2AAPOBEC3AAPOBEC3G
SCHEMBL24170233 0.82 NOTUM (0.44) NOTUMMEN1KMT2AAPOBEC3AAPOBEC3G
SCHEMBL12656578 0.80 NOTUM (0.50) NOTUMMEN1KMT2AKDM4EMAPT
Ammonia Solution, Strong SCHEMBL905929 0.78 NOTUM (0.49) NOTUMMEN1KMT2AKDM4EMAPT
SCHEMBL24169797 0.78 ALDH1A1 (0.70) MEN1KMT2AKDM4EMAPTTDP1
SCHEMBL11206551 0.76 CRHR1 (0.49) NOTUMMEN1KMT2AAPOBEC3AAPOBEC3G
SCHEMBL12656441 0.74 NOTUM (0.58) NOTUMMEN1KMT2AKDM4EMAPT
SCHEMBL12656474 0.74 NOTUM (0.44) NOTUMMEN1KMT2AAPOBEC3AAPOBEC3G
SCHEMBL19172300 0.74 NOTUM (0.51) NOTUMMEN1KMT2AKDM4EMAPT
SCHEMBL19148304 0.71 MAPT (0.58) NOTUMMEN1KMT2AKDM4EMAPT

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-3405454-B1 INDOLINE DERIVATIVES, COMPOSITIONS COMPRISING THEM AND USES THEREOF YISSUM RES DEV CO OF HEBREW UNIV JERUSALEM LTD (IL) 2021-12-29 EP disclosed