SCHEMBL17109651

SCHEMBL17109651

C=C(NC)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cc2)ccn1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 12/20 0.82
KDR P35968 6/20 0.82
BRAF P15056 5/20 0.82
RET P07949 3/20 0.82
RIPK2 O43353 2/20 0.82
ABCB11 O95342 2/20 0.82
ABL1 P00519 2/20 0.82
HTR1A P08908 2/20 0.82
PDGFRB P09619 2/20 0.82
ADORA3 P0DMS8 2/20 0.82
KIT P10721 2/20 0.82
FGFR1 P11362 2/20 0.82
PDGFRA P16234 2/20 0.82
FLT1 P17948 2/20 0.82
MAOA P21397 2/20 0.82
EPHA1 P21709 2/20 0.82
TBXA2R P21731 2/20 0.82
EPHA2 P29317 2/20 0.82
TTK P33981 2/20 0.82
EPHX2 P34913 2/20 0.82

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
Sorafenib SCHEMBL29349634 0.90 RAF1 (1.00) RAF1KDRBRAFRETRIPK2
Sorafenib SCHEMBL14739751 0.90 RAF1 (1.00) RAF1KDRBRAFRETRIPK2
Sorafenib SCHEMBL8218 0.90 RAF1 (1.00) RAF1KDRBRAFRETRIPK2
Sorafenib SCHEMBL28817561 0.90 RAF1 (0.98) RAF1KDRBRAFRETRIPK2
Sorafenib SCHEMBL1533976 0.90 RAF1 (0.98) RAF1KDRBRAFRETRIPK2
Sorafenib SCHEMBL28894639 0.90 RAF1 (0.98) RAF1KDRBRAFRETRIPK2
Sorafenib SCHEMBL1896610 0.90 RAF1 (0.98) RAF1KDRBRAFRETRIPK2
Sorafenib SCHEMBL1533982 0.90 RAF1 (0.98) RAF1KDRBRAFRETRIPK2
Sorafenib SCHEMBL18863920 0.90 RAF1 (0.98) RAF1KDRBRAFRETRIPK2
Sorafenib SCHEMBL1533981 0.90 RAF1 (0.98) RAF1KDRBRAFRETRIPK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230233691-A1 METHODS AND COMPOSITIONS FOR TREATING CHRONIC INFLAMMATORY INJURY, METAPLASIA, DYSPLASIA AND CANCERS OF EPITHELIAL TISSUES UNIVERSITY OF HOUSTON SYSTEM (US) 2023-07-27 US disclosed
US-20220202792-A1 METHODS AND COMPOSITIONS FOR TREATING CHRONIC INFLAMMATORY INJURY, METAPLASIA, DYSPLASIA AND CANCERS OF EPITHELIAL TISSUES UNIVERSITY OF HOUSTON SYSTEM (US) 2022-06-30 US disclosed
US-20210401987-A1 METHODS AND COMPOSITIONS FOR TREATING INFLAMMATORY AND FIBROTIC PULMONARY DISORDERS UNIVERSITY OF HOUSTON SYSTEM (US) 2021-12-30 US disclosed
US-20150267258-A1 BIOMARKERS FOR DETERMINING EFFECTIVE RESPONSE OF TREATMENTS OF HEPATOCELLULAR CARCINOMA (HCC) PATIENTS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-09-24 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-20210401987-A1 METHODS AND COMPOSITIONS FOR TREATING INFLAMMATORY AND FIBROTIC PULMONARY DISORDERS MMP1, MMP8, CCL11 RAF1 2232/4885KDR 3463/4885BRAF 3645/4885
US-20230233691-A1 METHODS AND COMPOSITIONS FOR TREATING CHRONIC INFLAMMATORY INJURY, METAPLASIA, DYSPLASIA AND CANCERS OF EPITHELIAL TISSUES FABP2, MYADM, FABP6 RAF1 1205/4885KDR 2501/4885BRAF 644/4885
US-20220202792-A1 METHODS AND COMPOSITIONS FOR TREATING CHRONIC INFLAMMATORY INJURY, METAPLASIA, DYSPLASIA AND CANCERS OF EPITHELIAL TISSUES FABP2, MUC1, FABP6 RAF1 932/4885KDR 3559/4885BRAF 703/4885
US-20150267258-A1 BIOMARKERS FOR DETERMINING EFFECTIVE RESPONSE OF TREATMENTS OF HEPATOCELLULAR CARCINOMA (HCC) PATIENTS NRAS, KRAS, TP53 RAF1 9/4885KDR 120/4885BRAF 6/4885

“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.