SCHEMBL1977295

SCHEMBL1977295

O=C(NC1(C(=O)N[C@@H]2CCc3ccccc3-n3ccnc32)CCCC1)c1ccc(OC(F)F)cc1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 17/20 0.48
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HCRTR1 O43613 1/20 0.34
CTSL P07711 1/20 0.34
CTSB P07858 1/20 0.34
CTSS P25774 1/20 0.34

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
SCHEMBL12589526 1.00 RIPK1 (0.48) RIPK1NPC1RAB9ASMN1; SMN2HCRTR1
SCHEMBL13504421 0.97 RIPK1 (0.49) RIPK1NPC1RAB9ASMN1; SMN2HCRTR1
SCHEMBL15911606 0.97 RIPK1 (0.49) RIPK1NPC1RAB9ASMN1; SMN2HCRTR1
SCHEMBL15911360 0.88 RIPK1 (0.55) RIPK1CTSL
SCHEMBL1977282 0.88 RIPK1 (0.55) RIPK1CTSL
SCHEMBL15911546 0.88 RIPK1 (0.49) RIPK1NPC1RAB9A
SCHEMBL12589524 0.88 RIPK1 (0.49) RIPK1NPC1RAB9A
SCHEMBL15911572 0.87 RIPK1 (0.49) RIPK1SMN1; SMN2
SCHEMBL1979174 0.87 RIPK1 (0.49) RIPK1SMN1; SMN2
SCHEMBL12589565 0.86 RIPK1 (0.51) RIPK1RAB9ASMN1; 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-2509981-B1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE LILLY CO ELI (US) 2014-08-06 EP disclosed
EP-2509981-B1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE LILLY CO ELI (US) 2014-08-06 EP disclosed
US-8299061-B2 Inhibitors of diacylglycerol acyltransferase ELI LILLY AND COMPANY (US) 2012-10-30 US disclosed
US-8299061-B2 Inhibitors of diacylglycerol acyltransferase ELI LILLY AND COMPANY (US) 2012-10-30 US disclosed
US-20110144091-A1 Inhibitors of Diacylglycerol Acyltransferase ELI LILLY AND COMPANY (US) 2011-06-16 US disclosed
US-20110144091-A1 Inhibitors of Diacylglycerol Acyltransferase ELI LILLY AND COMPANY (US) 2011-06-16 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-20110144091-A1 Inhibitors of Diacylglycerol Acyltransferase DGAT1, DGAT2, LCAT RIPK1 3703/4885NPC1 286/4885RAB9A 2443/4885

“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.