SCHEMBL17618672

SCHEMBL17618672

N#Cc1ccccc1-c1ccc2c(n1)N(C(=O)Nc1cnccn1)[C@H]1CCCN2C1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PIM2 Q9P1W9 8/20 0.38
▸ PIM3 Q86V86 5/20 0.38
▸ PIM1 P11309 5/20 0.38
▸ DPP4 P27487 1/20 0.36
▸ ROCK2 O75116 1/20 0.35
▸ ROCK1 Q13464 1/20 0.35
▸ CDC42BPB Q9Y5S2 1/20 0.35
▸ FAAH O00519 2/20 0.35
▸ PRKCA P17252 1/20 0.35
▸ GSK3B P49841 1/20 0.35
▸ PRKCQ Q04759 1/20 0.35
▸ ABL1 P00519 1/20 0.35
▸ LRRK2 Q5S007 1/20 0.34
▸ UCHL1 P09936 3/20 0.34
▸ USP30 Q70CQ3 1/20 0.34
▸ CDK5 Q00535 1/20 0.34
▸ CDK5R1 Q15078 1/20 0.34
▸ CHEK1 O14757 1/20 0.34
▸ IRAK4 Q9NWZ3 1/20 0.33

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
SCHEMBL17618668 0.91 CHRM4 (0.36) PIM2PIM3PIM1DPP4ROCK2
SCHEMBL17618667 0.89 PIM2 (0.37) PIM2PIM3PIM1DPP4ROCK2
SCHEMBL17618660 0.88 HTR2C (0.43) PIM2PIM3PIM1
SCHEMBL17618651 0.86 FAAH (0.37) PIM2PIM3PIM1DPP4ROCK2
SCHEMBL17618600 0.84 USP30 (0.44) PRKCQLRRK2UCHL1USP30
SCHEMBL17618671 0.84 PIM3 (0.45) PIM2PIM3PIM1ROCK2ROCK1
SCHEMBL17618722 0.84 PIM1 (0.40) PIM2PIM3PIM1ROCK2ROCK1
SCHEMBL17618658 0.83 PIM2 (0.37) PIM2PIM3PIM1LRRK2UCHL1
SCHEMBL17618662 0.82 FAAH (0.39) PIM2DPP4FAAHABL1LRRK2
SCHEMBL19699082 0.80 PIM2 (0.35) PIM2PIM3PIM1DPP4LRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10590135-B2 Substituted bridged urea analogs as sirtuin modulators GLAXOSMITHKLINE LLC (US) 2020-03-17 — — US disclosed
US-20170355697-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2017-12-14 — — US disclosed
US-20170355697-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2017-12-14 — — US disclosed
US-9834558-B2 Substituted bridged urea analogs as sirtuin modulators GLAXOSMITHKLINE LLC (US) 2017-12-05 — — US disclosed
US-9834558-B2 Substituted bridged urea analogs as sirtuin modulators GLAXOSMITHKLINE LLC (US) 2017-12-05 — — US disclosed
US-9765075-B2 Substituted bridged urea analogs as sirtuin modulators GLAXOSMITHKLINE LLC (US) 2017-09-19 — — US disclosed
US-9765075-B2 Substituted bridged urea analogs as sirtuin modulators GLAXOSMITHKLINE LLC (US) 2017-09-19 — — US disclosed
US-20160083386-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2016-03-24 — — US disclosed
US-20160083386-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2016-03-24 — — 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 (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-20160083386-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 PIM2 3491/4885PIM3 3869/4885PIM1 3195/4885
US-20170355697-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 PIM2 3242/4885PIM3 3489/4885PIM1 2799/4885
US-10590135-B2 Substituted bridged urea analogs as sirtuin modulators SIRT1, SIRT3, SIRT2 PIM2 3242/4885PIM3 3489/4885PIM1 2799/4885

“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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