SCHEMBL19225918

SCHEMBL19225918

Cc1cc(C(=O)Nc2ccc(OC(F)(F)F)cc2)cnc1Cl

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 17/20 0.68
▸ MEN1 O00255 2/20 0.60
▸ KMT2A Q03164 2/20 0.60
▸ HTT P42858 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ TRPV1 Q8NER1 1/20 0.55

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
SCHEMBL19226034 0.92 ABL1 (0.69) ABL1
SCHEMBL15391645 0.88 ABL1 (0.71) ABL1MEN1KMT2AHTTSMN1; SMN2
SCHEMBL15388266 0.86 ABL1 (0.68) ABL1MEN1KMT2AHTTSMN1; SMN2
SCHEMBL15391654 0.86 ABL1 (0.68) ABL1MEN1KMT2AHTTSMN1; SMN2
SCHEMBL15388382 0.86 ABL1 (0.69) ABL1MEN1KMT2AHTTSMN1; SMN2
SCHEMBL15391649 0.85 ABL1 (0.61) ABL1MEN1KMT2A
SCHEMBL15391683 0.83 ABL1 (0.64) ABL1MEN1KMT2AHTTSMN1; SMN2
SCHEMBL15391366 0.81 ABL1 (1.00) ABL1
SCHEMBL19226013 0.80 TRPV1 (0.68) ABL1MEN1KMT2AHTTSMN1; SMN2
SCHEMBL16714121 0.79 ABL1 (1.00) ABL1

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-20180134695-A1 COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF ABL1, ABL2 AND BCR-ABL1 NOVARTIS AG (CH) 2018-05-17 — — US disclosed
EP-2861579-B1 BENZAMIDE DERIVATIVES FOR INHIBITING THE ACTIVITY OF ABL1, ABL2 AND BCR-ABL1 NOVARTIS AG (CH) 2018-02-21 — — EP disclosed
US-9896444-B2 Benzamide derivatives for inhibiting the activity of ABL1, ABL2 and BCR-ABL1 NOVARTIS AG (CH) 2018-02-20 — — US disclosed
EP-2900637-B1 THIAZOLE OR IMIDAZOLE SUBSTITUTED PYRIMIDINE, PYRIDINE AND PYRAZINE AMIDE DERIVATIVES AND RELATED COMPOUNDS AS ABL1, ABL2 AND BCR-ABL1 INHIBITORS FOR THE TREATMENT OF CANCER, SPECIFIC VIRAL INFECTIONS AND SPECIFIC CNS DISORDERS NOVARTIS AG (CH) 2017-08-09 — — EP 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 (1 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-20180134695-A1 COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF ABL1, ABL2 AND BCR-ABL1 ABL1, ABL2, BCR ABL1 1/4885MEN1 2110/4885KMT2A 315/4885

“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.

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