SCHEMBL4970130

SCHEMBL4970130

O=C(Nc1ccc(OC(F)(F)F)cc1)c1cc(F)cnc1Cl

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 14/20 0.67
▸ NPC1 O15118 1/20 0.56
▸ RAB9A P51151 1/20 0.56
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ MEN1 O00255 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ HTT P42858 1/20 0.51
▸ SMN1; SMN2 Q16637 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
SCHEMBL4967913 0.89 ABL1 (0.64) ABL1NPC1RAB9AL3MBTL1MEN1
SCHEMBL4966684 0.84 NFKB1 (0.58) ABL1NPC1RAB9AHTTSMN1; SMN2
SCHEMBL4970824 0.83 P2RX1 (0.54) ABL1NPC1RAB9AMEN1KMT2A
SCHEMBL4968769 0.83 NR3C1 (0.52) ABL1NPC1RAB9AMEN1KMT2A
SCHEMBL4969220 0.81 NFKB1 (0.47) ABL1RAB9AHTT
SCHEMBL4967520 0.81 RAB9A (0.53) ABL1NPC1RAB9AMEN1KMT2A
SCHEMBL4971162 0.81 RAB9A (0.51) NPC1RAB9AMEN1KMT2AHTT
SCHEMBL15392342 0.80 ABL1 (1.00) ABL1
SCHEMBL1499586 0.80 MAPT (0.61) ABL1NPC1RAB9AL3MBTL1MEN1
SCHEMBL4966677 0.80 RAB9A (0.51) NPC1RAB9AMEN1KMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8247556-B2 Method for preparing 6-substituted-7-aza-indoles AMGEN INC. (US) 2012-08-21 — — US disclosed
EP-1971604-B1 PYRROLO-PYRIDINE DERIVATIVES FOR THE TREATMENT OF CANCER DISEASES AMGEN INC (US) 2012-08-01 — — EP disclosed
EP-1971604-A2 PYRROLO-PYRIDINE DERIVATIVES FOR THE TREATMENT OF CANCER DISEASES Amgen Inc. (US) 2008-09-24 — — EP disclosed
US-20070185171-A1 Compounds and methods of use AMGEN INC. 2007-08-09 — — US disclosed
WO-2007048070-A2 PYRROLO-PYRIDINE DERIVATIVES FOR THE TREATMENT OF CANCER DISEASES AMGEN INC. (US) 2007-04-26 — — 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 (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-20070185171-A1 Compounds and methods of use VHL, PGF, PTGIS ABL1 1280/4885NPC1 176/4885RAB9A 2012/4885

“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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