SCHEMBL10907968

SCHEMBL10907968

CC(C)(C)c1cc(O)c(Cl)cc1Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.56
ALOX15 P16050 5/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
CYP1A2 P05177 2/20 0.56
MAPT P10636 2/20 0.56
KDM4E B2RXH2 1/20 0.56
ATP2A2 P16615 1/20 0.56
ATP2A3 Q93084 1/20 0.56
TSHR P16473 7/20 0.52
HSD17B10 Q99714 5/20 0.52
HPGD P15428 3/20 0.52
LMNA P02545 3/20 0.42
TP53 P04637 3/20 0.42
CYP3A4 P08684 3/20 0.42
CYP2C9 P11712 3/20 0.41
TYR P14679 2/20 0.41
NR1I2 O75469 1/20 0.41
MIF P14174 1/20 0.41
HTT P42858 1/20 0.41
NFE2L2 Q16236 1/20 0.41

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
SCHEMBL10938794 0.91 TSHR (0.52) ALDH1A1ALOX15SMN1; SMN2CYP1A2MAPT
SCHEMBL9503098 0.86 ALDH1A1 (0.71) ALDH1A1ALOX15SMN1; SMN2CYP1A2MAPT
SCHEMBL16736702 0.86 ALOX15 (0.71) ALDH1A1ALOX15SMN1; SMN2CYP1A2MAPT
SCHEMBL22984907 0.82 ALDH1A1 (0.52) ALDH1A1ALOX15SMN1; SMN2CYP1A2MAPT
SCHEMBL16736848 0.82 ALOX15 (0.52) ALDH1A1ALOX15SMN1; SMN2CYP1A2MAPT
SCHEMBL13911912 0.82 ALDH1A1 (0.41) ALDH1A1ALOX15SMN1; SMN2CYP1A2MAPT
SCHEMBL4126691 0.81 ALOX15 (0.64) ALDH1A1ALOX15SMN1; SMN2CYP1A2MAPT
SCHEMBL814392 0.80 ALDH1A1 (0.50) ALDH1A1ALOX15SMN1; SMN2CYP1A2MAPT
SCHEMBL12733032 0.79 SMN1; SMN2 (0.42) ALDH1A1ALOX15SMN1; SMN2CYP1A2MAPT
SCHEMBL31497679 0.79 SMN1; SMN2 (0.45) ALDH1A1ALOX15SMN1; SMN2CYP1A2MAPT

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-10919850-B2 Covalent inhibitors of KRas G12C ARAXES PHARMA LLC (US) 2021-02-16 US disclosed
US-20190262342-A1 COMBINATION THERAPIES FOR TREATMENT OF CANCER ARAXES PHARMA LLC 2019-08-29 US disclosed
US-9926267-B2 Covalent inhibitors of K-Ras G12C ARAXES PHARMA LLC (US) 2018-03-27 US disclosed
US-20160166571-A1 COMBINATION THERAPIES FOR TREATMENT OF CANCER ARAXES PHARMA LLC 2016-06-16 US disclosed
US-9227978-B2 Covalent inhibitors of Kras G12C ARAXES PHARMA LLC (US) 2016-01-05 US disclosed
US-20140288045-A1 COVALENT INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2014-09-25 US disclosed
US-4588835-A Process for preparing alkoxyphenols OTSUKA KAGAKU YAKUHIN KABUSHIKI KAISHA (JP) 1986-05-13 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 (4 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 ALDH1A1 2706/4885ALOX15 4571/4885SMN1; SMN2 3761/4885
US-20190262342-A1 COMBINATION THERAPIES FOR TREATMENT OF CANCER KRAS, TP53, HRAS ALDH1A1 1577/4885ALOX15 4380/4885SMN1; SMN2 3583/4885
US-10919850-B2 Covalent inhibitors of KRas G12C KRAS, NRAS, HRAS ALDH1A1 2706/4885ALOX15 4571/4885SMN1; SMN2 3761/4885
US-20160166571-A1 COMBINATION THERAPIES FOR TREATMENT OF CANCER KRAS, TP53, HRAS ALDH1A1 1577/4885ALOX15 4380/4885SMN1; SMN2 3583/4885

“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.