SCHEMBL22004306

SCHEMBL22004306

Cc1ccccc1-c1cc2cc(Cl)ccc2n1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.49
KMT2A Q03164 6/20 0.46
KDM4E B2RXH2 4/20 0.46
MEN1 O00255 4/20 0.46
ALDH1A1 P00352 3/20 0.46
HPGD P15428 2/20 0.46
MAPT P10636 2/20 0.46
RECQL P46063 1/20 0.46
PDE2A O00408 1/20 0.42
PDE10A Q9Y233 1/20 0.42
NPC1 O15118 1/20 0.41
CASP3 P42574 1/20 0.41
RAB9A P51151 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
CYP1A2 P05177 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
HCRTR1 O43613 1/20 0.39
CASP1 P29466 1/20 0.39

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
SCHEMBL9241728 0.82 MAPT (0.67) KMT2AKDM4EMEN1ALDH1A1HPGD
SCHEMBL30078373 0.82 MAPT (0.67) KMT2AKDM4EMEN1ALDH1A1HPGD
SCHEMBL22004305 0.81 ACLY (0.47) ACLYKMT2AKDM4EMEN1ALDH1A1
SCHEMBL22021591 0.80 KMT2A (0.46) ACLYKMT2AKDM4EMEN1ALDH1A1
SCHEMBL28864925 0.79 KMT2A (0.44) ACLYKMT2AKDM4EMEN1ALDH1A1
SCHEMBL8942357 0.79 KMT2A (0.66) ACLYKMT2AMEN1ALDH1A1HPGD
SCHEMBL6492730 0.79 HSD11B1 (0.50) KMT2AKDM4EMEN1ALDH1A1HPGD
SCHEMBL12583871 0.79 KMT2A (0.54) ACLYKMT2AKDM4EMEN1ALDH1A1
SCHEMBL23704226 0.78 ALOX15 (0.45) KMT2AKDM4EMEN1ALDH1A1HPGD
SCHEMBL23704327 0.78 KMT2A (0.43) KMT2AKDM4EMEN1ALDH1A1HPGD

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-20200157076-A1 ACLY INHIBITORS AND USES THEREOF NIMBUS DISCOVERY, INC. 2020-05-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200157076-A1 ACLY INHIBITORS AND USES THEREOF ACLY, ATP5ME, ATP5MG ACLY 1/4885KMT2A 1976/4885KDM4E 1181/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.