SCHEMBL15051538

SCHEMBL15051538

Cc1cnc(NC(=O)C2CC2)cc1-n1cc(CO)c(-c2ccccc2Cl)n1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 19/20 0.49
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL15051676 0.85 ABL1 (0.49) ABL1NPC1RAB9ASMN1; SMN2
SCHEMBL15051264 0.84 ABL1 (0.47) ABL1NPC1RAB9ASMN1; SMN2
SCHEMBL15051487 0.84 ABL1 (0.47) ABL1NPC1RAB9ASMN1; SMN2
SCHEMBL15051722 0.82 ABL1 (0.47) ABL1NPC1RAB9ASMN1; SMN2
SCHEMBL15051695 0.80 GAA (0.41) NPC1RAB9ASMN1; SMN2
SCHEMBL15051164 0.77 ABL1 (0.44) ABL1NPC1RAB9ASMN1; SMN2
SCHEMBL15051645 0.76 PIK3C3 (0.39) ABL1SMN1; SMN2
SCHEMBL15051599 0.76 DHODH (0.43) ABL1SMN1; SMN2
SCHEMBL15051710 0.75 SCN9A (0.40) ABL1SMN1; SMN2
SCHEMBL15051293 0.74 MAPT (0.40) ABL1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2793880-A1 HETEROARYLS AND USES THEREOF Millennium Pharmaceuticals, Inc. (US) 2014-10-29 EP disclosed
WO-2013096630-A1 HETEROARYLS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-06-27 WO disclosed
WO-2013096630-A1 HETEROARYLS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-06-27 WO disclosed
US-20130165464-A1 HETEROARYLS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-06-27 US disclosed
US-20130165464-A1 HETEROARYLS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-06-27 US disclosed
US-20130165464-A1 HETEROARYLS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-06-27 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 (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-20130165464-A1 HETEROARYLS AND USES THEREOF PIK3C2B, PI4KB, PIK3R4 ABL1 801/4885NPC1 819/4885RAB9A 119/4885

“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.