SCHEMBL16336089

SCHEMBL16336089

CONC(=O)C1CCC(NC(=O)O)CC1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 1/20 0.37
TSHR P16473 1/20 0.34
KDM4E B2RXH2 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
LMNA P02545 2/20 0.33
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
ALDH1A1 P00352 2/20 0.33
SMYD3 Q9H7B4 1/20 0.33
MAPK1 P28482 1/20 0.33
GAA P10253 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
SCHEMBL16336090 1.00 POLB (0.40) POLBNPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL31623279 0.84 HSD17B10 (0.46) POLBNPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL6971012 0.84
SCHEMBL23573567 0.80 POLB (0.59) POLBHSD17B10TSHRLMNAALDH1A1
SCHEMBL3196038 0.80 POLB (0.59) POLBHSD17B10TSHRLMNAALDH1A1
SCHEMBL23573569 0.80 POLB (0.59) POLBHSD17B10TSHRLMNAALDH1A1
SCHEMBL3196032 0.80 POLB (0.59) POLBHSD17B10TSHRLMNAALDH1A1
SCHEMBL15405161 0.79 POLB (0.44) POLBNPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL15405160 0.79 POLB (0.44) POLBNPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL3199998 0.79 POLB (0.44) POLBSMN1; SMN2HSD17B10LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2791139-B1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS TROPOMYOSIN RECEPTOR KINASE A (TRKA) INHIBITORS Dr Reddys Laboratories Ltd (IN) 2017-11-08 EP disclosed
US-20150005280-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS TROPOMYOSIN RECEPTOR KINASE A (TRKA) INHIBITORS DR. REDDY'S LABORATORIES LTD. (IN) 2015-01-01 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-20150005280-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS TROPOMYOSIN RECEPTOR KINASE A (TRKA) INHIBITORS NTRK1, MUSK, NTRK3 POLB 3709/4885NPC1 3182/4885RAB9A 1861/4885

“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.