SCHEMBL25834915

SCHEMBL25834915

COC(=O)c1cc(Cl)nc(-c2ccc(F)cc2)n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 11/20 0.55
FPR2 P25090 10/20 0.55
MAPT P10636 1/20 0.47
ADORA3 P0DMS8 2/20 0.45
ADORA2A P29274 2/20 0.45
NPC1 O15118 1/20 0.45
CASP3 P42574 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
SENP8 Q96LD8 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
SENP6 Q9GZR1 1/20 0.45
PTGS2 P35354 1/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
ALOX15 P16050 1/20 0.43
HSD17B10 Q99714 1/20 0.43
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42

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
SCHEMBL28185733 0.86 MAPT (0.52) SCN9AFPR2MAPTNPC1RAB9A
SCHEMBL787732 0.84 SCN9A (0.55) SCN9AFPR2MAPTNPC1CASP3
SCHEMBL523886 0.82 SCN9A (0.49) SCN9AFPR2ADORA3ADORA2APTGS2
SCHEMBL21044494 0.79 MAPT (0.54) SCN9AFPR2MAPTNPC1CASP3
SCHEMBL25299294 0.78 SMN1; SMN2 (0.52) SCN9AFPR2MAPTADORA3ADORA2A
SCHEMBL30510125 0.78 SMN1; SMN2 (0.52) SCN9AFPR2MAPTADORA3ADORA2A
SCHEMBL30007819 0.77 NPC1 (0.51) SCN9AMAPTADORA3ADORA2ANPC1
SCHEMBL30405699 0.77 NPC1 (0.51) SCN9AFPR2MAPTADORA3ADORA2A
SCHEMBL25241472 0.77 NPC1 (0.51) SCN9AFPR2MAPTADORA3ADORA2A
SCHEMBL16533700 0.77 NPC1 (0.51) SCN9AMAPTADORA3ADORA2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107698517-A One kind 2(4 fluorophenyls)The preparation method of pyrimidine derivatives 湖南华腾制药有限公司 2018-02-16 CN claimed
CN-107286100-A A kind of preparation method of 2- substituted pyrimidines derivative 湖南华腾制药有限公司 2017-10-24 CN claimed
US-12030866-B2 2-pyrazole anilines and related analogs for inhibiting YAP/TAZ-TEAD SPRINGWORKS THERAPEUTICS, INC. (US) 2024-07-09 US disclosed
US-12030866-B2 2-pyrazole anilines and related analogs for inhibiting YAP/TAZ-TEAD SPRINGWORKS THERAPEUTICS, INC. (US) 2024-07-09 US disclosed
WO-2023122780-A9 2-PYRAZOLE ANILINES AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD THE KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-11-30 WO disclosed
US-20230278982-A1 2-Pyrazole Anilines and Related Analogs for Inhibiting YAP/TAZ-TEAD KU LEUVEN R&D (BE) 2023-09-07 US disclosed
US-20230278982-A1 2-Pyrazole Anilines and Related Analogs for Inhibiting YAP/TAZ-TEAD KU LEUVEN R&D (BE) 2023-09-07 US disclosed
WO-2023122780-A2 2-PYRAZOLE ANILINES AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD THE KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-06-29 WO disclosed
CN-107286100-A A kind of preparation method of 2- substituted pyrimidines derivative 湖南华腾制药有限公司 2017-10-24 CN 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-20230278982-A1 2-Pyrazole Anilines and Related Analogs for Inhibiting YAP/TAZ-TEAD YAP1, TEAD3, TEAD2 SCN9A 4419/4885FPR2 2652/4885MAPT 2994/4885
US-12030866-B2 2-pyrazole anilines and related analogs for inhibiting YAP/TAZ-TEAD YAP1, TEAD3, TEAD2 SCN9A 4419/4885FPR2 2652/4885MAPT 2994/4885

“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.