Sorafenib

Sorafenib

SCHEMBL15939735

CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cc2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cc2)ccn1.Cc1ccc(S(=O)(=O)O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

BRAFFLT1FLT3FLT4KDRKITPDGFRBRAF1RET

The experimentally established mechanism targets of Sorafenib. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR known ✓ P35968 5/20 1.00
RAF1 known ✓ P04049 12/20 0.81
BRAF known ✓ P15056 4/20 0.81
RET known ✓ P07949 3/20 0.81
PDGFRB known ✓ P09619 2/20 0.81
KIT known ✓ P10721 2/20 0.81
FLT1 known ✓ P17948 2/20 0.81
FLT4 known ✓ P35916 2/20 0.81
FLT3 known ✓ P36888 2/20 0.81
AURKB Q96GD4 2/20 1.00
NTSR1 P30989 1/20 1.00
MC4R P32245 1/20 1.00
PAX8 Q06710 1/20 1.00
RIPK2 O43353 2/20 0.81
ABCB11 O95342 2/20 0.81
ABL1 P00519 2/20 0.81
HTR1A P08908 2/20 0.81
ADORA3 P0DMS8 2/20 0.81
FGFR1 P11362 2/20 0.81
PDGFRA P16234 2/20 0.81

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 SCHEMBL162935 1.00 KDR (1.00) KDRAURKBNTSR1MC4RPAX8
Sorafenib SCHEMBL29919725 1.00 KDR (1.00) KDRAURKBNTSR1MC4RPAX8
Sorafenib SCHEMBL18496409 1.00 KDR (1.00) KDRAURKBNTSR1MC4RPAX8
Sorafenib SCHEMBL28204502 0.99 KDR (0.98) KDRAURKBNTSR1MC4RPAX8
Sorafenib SCHEMBL3660939 0.99 KDR (0.98) KDRAURKBNTSR1MC4RPAX8
Sorafenib SCHEMBL16051185 0.97 KDR (0.94) KDRAURKBNTSR1MC4RPAX8
Sorafenib SCHEMBL3664023 0.97 KDR (0.94) KDRAURKBNTSR1MC4RPAX8
Cm-4307 SCHEMBL14673524 0.95 KDR (0.90) KDRAURKBNTSR1MC4RPAX8
Sorafenib SCHEMBL19322 0.93 KDR (0.87) KDRAURKBNTSR1MC4RPAX8
Sorafenib SCHEMBL18264082 0.93 KDR (0.86) KDRAURKBNTSR1MC4RPAX8

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
US-10928405-B2 Devices and methods for determining and/or isolating cells such as circulating cancer or fetal cells ANALIZA, INC. (US) 2021-02-23 US disclosed
EP-3080341-B1 METHODS FOR DETERMINING AND/OR ISOLATING CELLS SUCH AS CIRCULATING CANCER OR FETAL CELLS ANALIZA INC (US) 2020-02-12 EP disclosed
US-20190178901-A1 DEVICES AND METHODS FOR DETERMINING AND/OR ISOLATING CELLS SUCH AS CIRCULATING CANCER OR FETAL CELLS ANALIZA, INC. (US) 2019-06-13 US disclosed
EP-2739143-B1 PREPARATION AND METHODS OF USE FOR ORTHO-ARYL 5- MEMBERED HETEROARYL-CARBOXAMIDE CONTAINING MULTI-TARGETED KINASE INHIBITORS FLYNN GARY A (US) 2018-07-11 EP disclosed
US-9833455-B2 Preparation and methods of use for ortho-aryl 5-membered heteroaryl-carboxamide containing multi-targeted kinase inhibitors SPACEFILL ENTERPRISES LLC (US) 2017-12-05 US disclosed
US-20160303128-A1 PREPARATION AND METHODS OF USE FOR ORTHO-ARYL 5-MEMBERED HETEROARYL-CARBOXAMIDE CONTAINING MULTI-TARGETED KINASE INHIBITORS VIBLIOME THERAPEUTICS, LLC 2016-10-20 US disclosed
US-9221805-B2 Preparation and methods of use for ortho-aryl 5-membered heteroaryl-carboxamide containing multi-targeted kinase inhibitors Spacefill Enterprises LLP (US) 2015-12-29 US disclosed
US-20150160246-A1 DEVICES AND METHODS FOR DETERMINING AND/OR ISOLATING CELLS SUCH AS CIRCULATING CANCER OR FETAL CELLS ANALIZA, INC. (US) 2015-06-11 US disclosed
US-20140228367-A1 PREPARATION AND METHODS OF USE FOR ORTHO-ARYL 5-MEMBERED HETEROARYL-CARBOXAMIDE CONTAINING MULTI-TARGETED KINASE INHIBITORS VIBLIOME THERAPEUTICS, LLC 2014-08-14 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 (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-20160303128-A1 PREPARATION AND METHODS OF USE FOR ORTHO-ARYL 5-MEMBERED HETEROARYL-CARBOXAMIDE CONTAINING MULTI-TARGETED KINASE INHIBITORS ABL1, ERBB2, MAP3K2 KDR 308/4885RAF1 95/4885BRAF 49/4885
US-20140228367-A1 PREPARATION AND METHODS OF USE FOR ORTHO-ARYL 5-MEMBERED HETEROARYL-CARBOXAMIDE CONTAINING MULTI-TARGETED KINASE INHIBITORS ABL1, ERBB2, MAP3K2 KDR 308/4885RAF1 95/4885BRAF 49/4885

“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.