SCHEMBL19699555

SCHEMBL19699555

CCCCOc1cccc(NC(=O)C(C)C)n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 2/20 0.55
SMN1; SMN2 Q16637 4/20 0.49
NPC1 O15118 4/20 0.49
RAB9A P51151 4/20 0.49
TP53 P04637 4/20 0.49
MAPT P10636 3/20 0.49
LMNA P02545 2/20 0.49
HSD17B10 Q99714 1/20 0.49
CHRNB2 P17787 6/20 0.46
CHRNA4 P43681 6/20 0.46
CHRNB4 P30926 5/20 0.46
CHRNA3 P32297 5/20 0.46
XIAP P98170 1/20 0.43
BIRC2 Q13490 1/20 0.43
PKM P14618 1/20 0.40
TSHR P16473 2/20 0.39
ADORA3 P0DMS8 2/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
GBA1 P04062 1/20 0.39

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
SCHEMBL20733204 0.89 MAPK8 (0.51) MAPK8SMN1; SMN2NPC1RAB9ATP53
SCHEMBL19699592 0.88 MAPK8 (0.52) MAPK8SMN1; SMN2NPC1RAB9AMAPT
SCHEMBL19699551 0.84 MAPK8 (0.49) MAPK8SMN1; SMN2MAPTCHRNB2CHRNA4
SCHEMBL19706708 0.83 MAPK8 (0.48) MAPK8SMN1; SMN2NPC1RAB9ATP53
SCHEMBL19699549 0.79 MAPK8 (0.49) MAPK8SMN1; SMN2RAB9AMAPTLMNA
SCHEMBL19699584 0.79 MAPK8 (0.49) MAPK8SMN1; SMN2RAB9AMAPTLMNA
SCHEMBL19699554 0.78 MAPK8 (0.48) MAPK8SMN1; SMN2NPC1RAB9ATP53
SCHEMBL28890391 0.76 XIAP (0.49) MAPK8SMN1; SMN2RAB9ATP53XIAP
SCHEMBL10083508 0.74 CHRNB2 (0.51) MAPK8SMN1; SMN2RAB9ACHRNB2CHRNA4
SCHEMBL2520179 0.74 LTA4H (0.50) MAPTLMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170355705-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-12-14 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-20170355705-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 MAPK8 1686/4885SMN1; SMN2 2016/4885NPC1 3073/4885

“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.