SCHEMBL24966201

SCHEMBL24966201

CC(=O)c1c(Cl)ncn1[C@H](C)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
MEN1 O00255 1/20 0.48
HPGD P15428 1/20 0.48
KMT2A Q03164 1/20 0.48
HSD17B10 Q99714 1/20 0.48
MAPK1 P28482 1/20 0.43
GABRA1 P14867 3/20 0.41
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 2/20 0.41
GABRB2 P47870 2/20 0.41
CYP11B1 P15538 2/20 0.41
CYP11B2 P19099 2/20 0.41
LMNA P02545 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
ABCB11 O95342 1/20 0.41
GABRA2 P47869 1/20 0.41
P2RX7 Q99572 1/20 0.39
KDM5A P29375 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
SCHEMBL24966199 0.90 ALDH1A1 (0.52) ALDH1A1TDP1MEN1HPGDKMT2A
SCHEMBL28362059 0.90 ALDH1A1 (0.52) ALDH1A1TDP1MEN1HPGDKMT2A
SCHEMBL21298737 0.85 MAPK1 (0.55) ALDH1A1TDP1MEN1HPGDKMT2A
SCHEMBL22696854 0.84 MAPK1 (0.43) ALDH1A1TDP1MEN1HPGDKMT2A
SCHEMBL22696862 0.84 MAPK1 (0.41) ALDH1A1TDP1MEN1HPGDKMT2A
SCHEMBL23234258 0.84 MEN1 (0.49) ALDH1A1TDP1MEN1HPGDKMT2A
SCHEMBL24966171 0.82 ALDH1A1 (0.48) ALDH1A1TDP1MEN1HPGDKMT2A
SCHEMBL22696655 0.82 MAPK1 (0.40) ALDH1A1TDP1MEN1HPGDKMT2A
SCHEMBL24966196 0.81 MAPK1 (0.43) ALDH1A1TDP1MEN1HPGDKMT2A
SCHEMBL21298738 0.81 GABRA1 (0.59) ALDH1A1TDP1MEN1HPGDKMT2A

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-20230026724-A1 SUBSTITUTED NITROGEN HETEROCYCLIC COMPOUND AND ANESTHETIC EFFECT THEREOF CHENGDU MFS PHARMA. CO., LTD. (CN) 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-20230026724-A1 SUBSTITUTED NITROGEN HETEROCYCLIC COMPOUND AND ANESTHETIC EFFECT THEREOF CYP21A2, CYP11B1, CYP11B2 ALDH1A1 413/4885TDP1 3560/4885MEN1 2865/4885

“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.