SCHEMBL24692214

SCHEMBL24692214

NCc1ccc2c(c1)CN(O)C2=O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 3/20 0.38
▸ ITGA2B P08514 3/20 0.38
▸ GAA P10253 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ CASP1 P29466 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ CASP7 P55210 1/20 0.35
▸ SMAD3 P84022 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ TIPARP Q7Z3E1 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ AKR1B1 P15121 1/20 0.34

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
SCHEMBL18464134 0.83 HTR2A (0.46) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL29691298 0.80 USP1 (0.41) ITGB3ITGA2BGAAKDM4EMEN1
SCHEMBL18865618 0.80 USP1 (0.41) ITGB3ITGA2BGAAKDM4EMEN1
SCHEMBL25060934 0.77 HSD17B1 (0.41) KDM4EKMT2A
SCHEMBL26270098 0.75 IKZF2 (0.34) —
SCHEMBL30833835 0.74 METAP1 (0.47) MEN1KMT2AL3MBTL1
SCHEMBL27172637 0.74 METAP1 (0.47) MEN1KMT2AL3MBTL1
SCHEMBL30395950 0.73 KMT2A (0.38) ITGB3ITGA2BGAAKDM4EMEN1
Hydrochloric Acid SCHEMBL30080862 0.72 KMT2A (0.40) ITGB3ITGA2BGAAKDM4EMEN1
SCHEMBL27262174 0.71 MEN1 (0.36) ITGB3ITGA2BGAAKDM4EMEN1

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-20220387413-A1 ANTIPROLIFERATIVE COMPOUNDS AND METHODS OF USE THEREOF CELGENE CORP (US) 2022-12-08 — — 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-20220387413-A1 ANTIPROLIFERATIVE COMPOUNDS AND METHODS OF USE THEREOF MCL1, MKI67, BAX ITGB3 3113/4885ITGA2B 3109/4885GAA 316/4885

“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.

Send feedback