SCHEMBL7356937

SCHEMBL7356937

CCC(=O)CCc1nc(C)cs1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.39
MAPT P10636 2/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NPC1 O15118 4/20 0.38
RAB9A P51151 3/20 0.38
HSP90AA1 P07900 1/20 0.38
ADAMTS5 Q9UNA0 1/20 0.37
IAPP P10997 2/20 0.37
KMT2A Q03164 2/20 0.35
NOS1 P29475 1/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
MEN1 O00255 1/20 0.34
PDE10A Q9Y233 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
SCHEMBL1398316 0.82 ADAMTS5 (0.42) SMN1; SMN2MAPTNPC1RAB9AHSP90AA1
SCHEMBL9659322 0.81 RAB9A (0.42) SMN1; SMN2MAPTALOX15TSHRHSD17B10
SCHEMBL6297776 0.78 SMN1; SMN2 (0.38) SMN1; SMN2MAPTALOX15TSHRHSD17B10
SCHEMBL12753492 0.78 SMN1; SMN2 (0.36) SMN1; SMN2MAPTALOX15TSHRHSD17B10
SCHEMBL1398311 0.76 ADAMTS5 (0.40) SMN1; SMN2MAPTALOX15TSHRHSD17B10
SCHEMBL1846533 0.76 RAB9A (0.41) SMN1; SMN2MAPTALOX15TSHRHSD17B10
SCHEMBL129530 0.75
SCHEMBL12530273 0.74 ALDH1A1 (0.44) SMN1; SMN2MAPTTSHRNPC1RAB9A
SCHEMBL634118 0.74
SCHEMBL5427662 0.74

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-8299064-B2 Fused polycyclic compounds having a heterocyclic ring(s) and pharmaceutical use thereof AJINOMOTO CO., INC. (JP) 2012-10-30 US disclosed
US-20110160191-A1 NEW FUSED POLYCYCLIC COMPOUNDS HAVING A HETEROCYCLIC RING(S) AND PHARMACEUTICAL USE THEREOF AJINOMOTO CO., INC. (JP) 2011-06-30 US disclosed
US-7928101-B2 Fused polycyclic compounds having a heterocyclic ring(s) and pharmaceutical use thereof AJINOMOTO CO., INC. (JP) 2011-04-19 US disclosed
EP-1112269-A2 HIV PROTEASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-07-04 EP disclosed
WO-2000015634-A2 HIV PROTEASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2000-03-23 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-20110160191-A1 NEW FUSED POLYCYCLIC COMPOUNDS HAVING A HETEROCYCLIC RING(S) AND PHARMACEUTICAL USE THEREOF SLC2A4, SLC2A1, SLC2A3 SMN1; SMN2 3891/4885MAPT 2800/4885ALOX15 4267/4885

“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.