SCHEMBL16093660

SCHEMBL16093660

COc1cc(Cl)c(-c2cc(Cl)ccc2Cl)cc1NCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ ALDH1A1 P00352 5/20 0.45
▸ KDM4E B2RXH2 4/20 0.45
▸ TDP1 Q9NUW8 4/20 0.45
▸ MAPT P10636 3/20 0.45
▸ TSHR P16473 2/20 0.45
▸ HPGD P15428 2/20 0.45
▸ GAA P10253 1/20 0.45
▸ POLB P06746 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.43
▸ KCNMA1 Q12791 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ S1PR2 O95136 1/20 0.41
▸ S1PR4 O95977 1/20 0.41
▸ S1PR3 Q99500 1/20 0.41
▸ CTSA P10619 1/20 0.41
▸ HIF1A Q16665 1/20 0.41
▸ PTGDR2 Q9Y5Y4 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
SCHEMBL24460022 0.82 ALDH1A1 (0.57) KMT2AMEN1ALDH1A1KDM4ETDP1
SCHEMBL16122887 0.82 ALDH1A1 (0.48) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL16122813 0.79 KRAS (0.53) KMT2AMEN1MAPTGAAPOLB
SCHEMBL16099111 0.77 HSD17B10 (0.49) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL16113642 0.77 SMN1; SMN2 (0.43) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL16122658 0.77 SMN1; SMN2 (0.43) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL16122721 0.76 KRAS (0.47) KMT2AMEN1MAPTGAAPOLB
SCHEMBL20259907 0.76 GAA (0.47) KMT2AMEN1ALDH1A1MAPTHPGD
SCHEMBL16117941 0.75 ALDH1A1 (0.54) ALDH1A1KDM4ETDP1MAPTTSHR
SCHEMBL22560928 0.75 SMN1; SMN2 (0.42) KMT2AMEN1ALDH1A1KDM4ETDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3401314-B1 COVALENT INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2023-11-08 — — EP disclosed
US-10919850-B2 Covalent inhibitors of KRas G12C ARAXES PHARMA LLC (US) 2021-02-16 — — US disclosed
US-10273207-B2 Covalent inhibitors of kras G12C ARAXES PHARMA LLC (US) 2019-04-30 — — US disclosed
US-20180162812-A1 COVALENT INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2018-06-14 — — US disclosed
US-9926267-B2 Covalent inhibitors of K-Ras G12C ARAXES PHARMA LLC (US) 2018-03-27 — — US disclosed
US-20160159738-A1 COVALENT INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2016-06-09 — — US disclosed
EP-2970121-A1 COVALENT INHIBITORS OF KRAS G12C Araxes Pharma LLC (US) 2016-01-20 — — EP disclosed
US-9227978-B2 Covalent inhibitors of Kras G12C ARAXES PHARMA LLC (US) 2016-01-05 — — US disclosed
WO-2014152588-A1 COVALENT INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2014-09-25 — — WO disclosed
WO-2014152588-A1 COVALENT INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2014-09-25 — — WO disclosed
US-20140288045-A1 COVALENT INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2014-09-25 — — 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 (5 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-20140288045-A1 COVALENT INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS KMT2A 535/4885MEN1 2271/4885ALDH1A1 2706/4885
US-20160159738-A1 COVALENT INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS KMT2A 535/4885MEN1 2271/4885ALDH1A1 2706/4885
US-20180162812-A1 COVALENT INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS KMT2A 535/4885MEN1 2271/4885ALDH1A1 2706/4885
US-10919850-B2 Covalent inhibitors of KRas G12C KRAS, NRAS, HRAS KMT2A 535/4885MEN1 2271/4885ALDH1A1 2706/4885
US-10273207-B2 Covalent inhibitors of kras G12C KRAS, NRAS, HRAS KMT2A 535/4885MEN1 2271/4885ALDH1A1 2706/4885

“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