SCHEMBL24424828

SCHEMBL24424828

COc1cnc(CN2C(=O)c3ccccc3C2=O)c(C(F)(F)F)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
GAA P10253 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42
KDM4E B2RXH2 4/20 0.41
LMNA P02545 2/20 0.41
HSD17B10 Q99714 2/20 0.41
RECQL P46063 1/20 0.41
CASP3 P42574 1/20 0.40
PDE10A Q9Y233 1/20 0.39
MAPK1 P28482 1/20 0.39
HPGD P15428 1/20 0.39
USP2 O75604 1/20 0.39
POLB P06746 1/20 0.39
ALDH1A1 P00352 1/20 0.39
PKM P14618 1/20 0.39
RAB9A P51151 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
SCHEMBL29585570 1.00 TSHR (0.42) TSHRGAAMEN1KMT2ACYP1A2
SCHEMBL24424804 0.72 KDM4E (0.33) TSHRGAAMEN1KMT2AKDM4E
SCHEMBL24424475 0.71 PDCD1 (0.35) TSHRGAAMEN1KMT2AKDM4E
SCHEMBL8299351 0.70 KDM4E (0.59) TSHRGAAMEN1KMT2ACYP1A2
SCHEMBL1057833 0.69 AGXT (0.48) TSHRGAAMEN1KMT2ACYP1A2
SCHEMBL2713566 0.69 GAA (0.42) TSHRGAAMEN1KMT2ACYP1A2
SCHEMBL6160194 0.68 KMT2A (0.53) GAAMEN1KMT2ACYP1A2CYP3A4
SCHEMBL2356362 0.68 NFKB1 (0.47) MEN1KMT2ACYP1A2CYP3A4CYP2C19
SCHEMBL24424803 0.68 PTGS1 (0.35) LMNA
SCHEMBL31214132 0.68 KDM4E (0.50) TSHRGAAMEN1KMT2ACYP1A2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116635380-A PPARgamma modulators and methods of use 卫材R&D管理有限公司 2023-08-22 CN disclosed
US-20230062861-A1 PPARg MODULATORS AND METHODS OF USE EISAI R&D MANAGEMENT CO., LTD. (JP) 2023-03-02 US disclosed
WO-2022099144-A1 ΡΡΑRγ MODULATORS AND METHODS OF USE Eisai R&D Mangement Co., Ltd. (JP) 2022-05-12 WO 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-20230062861-A1 PPARg MODULATORS AND METHODS OF USE PPARG, PPARA, PPARD TSHR 391/4885GAA 2221/4885MEN1 4809/4885

“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.