SCHEMBL24915532

SCHEMBL24915532

CCc1cc(C(=O)NCc2ccncc2)c2nccc(C(C)C)c2c1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
ALDH1A1 P00352 2/20 0.48
HPGD P15428 2/20 0.48
HTT P42858 2/20 0.48
MAPK1 P28482 3/20 0.44
GAA P10253 1/20 0.43
POLB P06746 2/20 0.42
MAPT P10636 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
PDE10A Q9Y233 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ATM Q13315 1/20 0.41
TSHR P16473 1/20 0.40
KDR P35968 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
SCHEMBL24916028 0.87 NAAA (0.42) LMNASMN1; SMN2GAAMAPTNPC1
SCHEMBL24915849 0.86 PLK1 (0.37) LMNASMN1; SMN2ALDH1A1HPGDHTT
SCHEMBL24916033 0.86 RAB9A (0.43) LMNASMN1; SMN2ALDH1A1HTTGAA
SCHEMBL24916257 0.85 HPGDS (0.39) LMNASMN1; SMN2ALDH1A1HPGDHTT
SCHEMBL24915997 0.84 GPR52 (0.39) ALDH1A1MAPTKDM4E
SCHEMBL24916013 0.83 MAP4K4 (0.40)
SCHEMBL24916011 0.81 PBK (0.38)
SCHEMBL24915525 0.81 CNR2 (0.46) POLBNPC1RAB9A
SCHEMBL24916411 0.80 ACE2 (0.40) LMNASMN1; SMN2ALDH1A1HPGDNPC1
SCHEMBL24916409 0.78 GABRA1 (0.43) ALDH1A1GAAMAPTNPC1RAB9A

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-20230026466-A1 WDR5 INHIBITORS AND MODULATORS VANDERBILT UNIVERSITY 2023-01-26 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-20230026466-A1 WDR5 INHIBITORS AND MODULATORS WDR5, WDR1, WDR3 LMNA 3551/4885SMN1; SMN2 2582/4885ALDH1A1 3815/4885

“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.