SCHEMBL16637057

SCHEMBL16637057

COC(=O)c1cc(C(F)(F)F)c(Cl)cc1N

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CFTR P13569 7/20 0.64
ABL1 P00519 1/20 0.51
KDM4E B2RXH2 4/20 0.50
MAPT P10636 3/20 0.50
GAA P10253 3/20 0.49
ALDH1A1 P00352 4/20 0.45
HSD17B10 Q99714 3/20 0.45
HPGD P15428 2/20 0.45
GLA P06280 1/20 0.45
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45
ATM Q13315 1/20 0.45
NOTUM Q6P988 3/20 0.44
NQO2 P16083 1/20 0.44
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
KDR P35968 2/20 0.40
PDGFRB P09619 1/20 0.40

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
SCHEMBL23040878 0.94 CFTR (0.68) CFTRABL1KDM4EMAPTGAA
SCHEMBL16528370 0.84 KDM4E (0.46) CFTRKDM4EMAPTGAAALDH1A1
SCHEMBL27447768 0.83 CFTR (0.47) CFTRABL1MAPTGAANOTUM
SCHEMBL30032160 0.83 CFTR (0.66) CFTRABL1KDM4EMAPTGAA
SCHEMBL22833380 0.83 CFTR (0.66) CFTRABL1KDM4EMAPTGAA
SCHEMBL16637275 0.82 CFTR (0.42) CFTRKDM4EMAPTALDH1A1HSD17B10
SCHEMBL1884944 0.81 GAA (0.64) CFTRABL1KDM4EMAPTGAA
SCHEMBL31565668 0.81 CFTR (0.64) CFTRABL1KDM4EMAPTGAA
SCHEMBL24525533 0.81 CFTR (0.64) CFTRABL1KDM4EMAPTGAA
SCHEMBL17110455 0.81 CFTR (0.56) CFTRABL1KDM4EMAPTGAA

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 53 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12234244-B2 Substituted piperazines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2025-02-25 US disclosed
US-12162893-B2 Tricyclic pyridones and pyrimidones ERASCA, INC. (US) 2024-12-10 US disclosed
US-20240352028-A1 SUBSTITUTED QUINAZOLINES AS INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2024-10-24 US disclosed
CN-118076612-A Sulfur-containing heteroaromatic tricyclic KRAS inhibitors 医睿世康药业研发公司 2024-05-24 CN disclosed
EP-4347603-A1 SULFUR-CONTAINING HETEROAROMATIC TRICYCLIC KRAS INHIBITORS Erasca, Inc. (US) 2024-04-10 EP disclosed
US-20240043441-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2024-02-08 US disclosed
US-11878985-B2 Substituted quinazolines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2024-01-23 US disclosed
US-11845761-B2 Tricyclic pyridones and pyrimidones ERASCA, INC. (US) 2023-12-19 US disclosed
US-20230303586-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2023-09-28 US disclosed
US-20230303586-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2023-09-28 US disclosed
US-20180118757-A1 SUBSTITUTED QUINAZOLINES AS INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2018-05-03 US disclosed
US-20180118757-A1 SUBSTITUTED QUINAZOLINES AS INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2018-05-03 US disclosed
US-9840516-B2 Substituted quinazolines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2017-12-12 US disclosed
US-9840516-B2 Substituted quinazolines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2017-12-12 US disclosed
CN-106488910-A Inhibitors of kras g12c 亚瑞克西斯制药公司 2017-03-08 CN disclosed
EP-3055290-A1 INHIBITORS OF KRAS G12C Araxes Pharma LLC (US) 2016-08-17 EP disclosed
US-20150239900-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2015-08-27 US disclosed
US-20150239900-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2015-08-27 US disclosed
WO-2015054572-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2015-04-16 WO disclosed
WO-2015054572-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2015-04-16 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 (9 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-12234244-B2 Substituted piperazines as inhibitors of KRAS G12C KRAS, NRAS, HRAS CFTR 326/4885ABL1 67/4885KDM4E 2534/4885
US-11845761-B2 Tricyclic pyridones and pyrimidones KRAS, NRAS, HRAS CFTR 1205/4885ABL1 111/4885KDM4E 2592/4885
US-11878985-B2 Substituted quinazolines as inhibitors of KRAS G12C KRAS, NRAS, HRAS CFTR 697/4885ABL1 82/4885KDM4E 3221/4885
US-20240352028-A1 SUBSTITUTED QUINAZOLINES AS INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS CFTR 697/4885ABL1 82/4885KDM4E 3221/4885
US-20180118757-A1 SUBSTITUTED QUINAZOLINES AS INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS CFTR 697/4885ABL1 82/4885KDM4E 3221/4885
US-20150239900-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS CFTR 524/4885ABL1 216/4885KDM4E 3220/4885
US-12162893-B2 Tricyclic pyridones and pyrimidones DHFR, TYMS, TYMP CFTR 1960/4885ABL1 147/4885KDM4E 3415/4885
US-20240043441-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS CFTR 524/4885ABL1 216/4885KDM4E 3220/4885
US-20230303586-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS CFTR 524/4885ABL1 216/4885KDM4E 3220/4885

“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.