SCHEMBL4740892

SCHEMBL4740892

Cc1c[nH]c2ncnc(Nc3cccc(Cl)c3)c12

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGFR P00533 16/20 0.65
ABL1 P00519 8/20 0.65
ABL2 P42684 2/20 0.65
BRAF P15056 3/20 0.64
TNNI3K Q59H18 3/20 0.64
TTBK1 Q5TCY1 1/20 0.59
TTBK2 Q6IQ55 1/20 0.59
SRC P12931 6/20 0.55
PRKCA P17252 5/20 0.55
PDGFRB P09619 1/20 0.55
PDGFRA P16234 1/20 0.55
CDK1 P06493 3/20 0.53
FADS1 O60427 1/20 0.51
ERBB2 P04626 1/20 0.51

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
SCHEMBL9928275 0.84 EGFR (0.58) EGFRABL1ABL2BRAFTNNI3K
SCHEMBL12655345 0.81 TTBK1 (0.55) EGFRABL1ABL2BRAFTNNI3K
SCHEMBL9928278 0.81 EGFR (0.58) EGFRABL1ABL2BRAFTNNI3K
SCHEMBL7022596 0.81 BRAF (0.60) EGFRABL1ABL2BRAFTNNI3K
Hydrochloric Acid SCHEMBL7017702 0.80 BRAF (0.59) EGFRABL1ABL2BRAFTNNI3K
SCHEMBL29406611 0.79 EGFR (1.00) EGFRABL1ABL2PRKCA
SCHEMBL4935748 0.79 EGFR (0.65) EGFRABL1ABL2TTBK1TTBK2
SCHEMBL2463632 0.79 EGFR (1.00) EGFRABL1ABL2PRKCA
SCHEMBL9943150 0.79 EGFR (0.53) EGFRABL1ABL2BRAFTNNI3K
SCHEMBL9896825 0.79 JAK3 (0.68) EGFRABL1ABL2

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
WO-2008089310-A2 DELTA 5 DESATURASE INHIBITORS FOR THE TREATMENT OF OBESITY LEXICON PHARMACEUTICALS, INC. (US) 2008-07-24 WO claimed
WO-2008089307-A2 DELTA 5 DESATURASE INHIBITORS FOR THE TREATMENT OF PAIN, INFLAMMATION AND CANCER LEXICON PHARMACEUTICALS, INC. (US) 2008-07-24 WO claimed
US-20240216316-A1 DIHOMO-GAMMA LINOLENIC ACID (DGLA) IS A NOVEL SENOLYTIC BUCK INST RES AGING (US) 2024-07-04 US disclosed
US-20080200458-A1 Methods and compositions for the treatment of body composition disorders LEXICON PHARMACEUTICALS, INC. 2008-08-21 US disclosed
US-20080194557-A1 Methods and compositions for the treatment of pain, inflammation and cancer LEXICON PHARMACEUTICALS, INC. 2008-08-14 US disclosed
WO-2008089310-A2 DELTA 5 DESATURASE INHIBITORS FOR THE TREATMENT OF OBESITY LEXICON PHARMACEUTICALS, INC. (US) 2008-07-24 WO disclosed
WO-2008089307-A2 DELTA 5 DESATURASE INHIBITORS FOR THE TREATMENT OF PAIN, INFLAMMATION AND CANCER LEXICON PHARMACEUTICALS, INC. (US) 2008-07-24 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 (3 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-20080194557-A1 Methods and compositions for the treatment of pain, inflammation and cancer TNF, IL6, CXCL8 EGFR 1259/4885ABL1 2163/4885ABL2 2006/4885
US-20240216316-A1 DIHOMO-GAMMA LINOLENIC ACID (DGLA) IS A NOVEL SENOLYTIC DAGLA, DAGLB, MGLL EGFR 2964/4885ABL1 4054/4885ABL2 4060/4885
US-20080200458-A1 Methods and compositions for the treatment of body composition disorders CPT1B, CPT1A, SHBG EGFR 3860/4885ABL1 1600/4885ABL2 704/4885

“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.