SCHEMBL24423786

SCHEMBL24423786

CC(=O)c1cnc(C#N)c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.39
KDM4E B2RXH2 3/20 0.39
POLB P06746 2/20 0.39
TDP1 Q9NUW8 1/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
MAPK1 P28482 4/20 0.35
MAPT P10636 4/20 0.35
HTT P42858 3/20 0.35
NPC1 O15118 2/20 0.35
OPRK1 P41145 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
S1PR4 O95977 1/20 0.35
HSP90AA1 P07900 1/20 0.35
S1PR1 P21453 1/20 0.35
AGTR1 P30556 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
RXFP1 Q9HBX9 1/20 0.35
AR P10275 1/20 0.33

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
SCHEMBL29584921 1.00 ALDH1A1 (0.39) ALDH1A1KDM4EPOLBTDP1CYP11B1
SCHEMBL24608334 0.84 HCAR2 (0.43) ALDH1A1KDM4EPOLBTDP1HTT
SCHEMBL14303299 0.83 POLB (0.39) ALDH1A1KDM4EPOLBTDP1HTT
SCHEMBL1062758 0.83 KDM4E (0.39) ALDH1A1KDM4EPOLBTDP1MAPK1
SCHEMBL4701159 0.82 TDP1 (0.44) ALDH1A1KDM4EPOLBTDP1MAPK1
SCHEMBL1007768 0.79 MAPT (0.43) ALDH1A1KDM4EPOLBTDP1MAPK1
SCHEMBL1008697 0.79 TDP1 (0.50) ALDH1A1TDP1MAPK1L3MBTL1
SCHEMBL31719508 0.79 TDP1 (0.50) ALDH1A1TDP1MAPK1L3MBTL1
SCHEMBL1060088 0.78 ALDH1A1 (0.40) ALDH1A1KDM4EPOLBTDP1MAPT
SCHEMBL27876453 0.76 S1PR3 (0.36) ALDH1A1MAPTS1PR4S1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12606541-B2 PPARg modulators and methods of use EISAI R&D MANAGEMENT CO., LTD. (JP) 2026-04-21 US disclosed
EP-4240736-A1 PPAR GAMMA MODULATORS AND METHODS OF USE Eisai R&D Management Co., Ltd. (JP) 2023-09-13 EP disclosed
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
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
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 (2 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 ALDH1A1 542/4885KDM4E 3945/4885POLB 992/4885
US-12606541-B2 PPARg modulators and methods of use PPARG, PPARA, PPARD ALDH1A1 1374/4885KDM4E 2304/4885POLB 2032/4885

“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.