SCHEMBL19959341

SCHEMBL19959341

C[C@@H](O)C1CCCN1C(=O)OC(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
LMNA P02545 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
UCHL1 P09936 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
SCHEMBL3420226 1.00 HSD17B10 (0.48) HSD17B10SMN1; SMN2NPC1ALDH1A1HPGD
SCHEMBL13343679 1.00 HSD17B10 (0.48) HSD17B10SMN1; SMN2NPC1ALDH1A1HPGD
SCHEMBL19637426 1.00 HSD17B10 (0.48) HSD17B10SMN1; SMN2NPC1ALDH1A1HPGD
SCHEMBL3571595 1.00 HSD17B10 (0.48) HSD17B10SMN1; SMN2NPC1ALDH1A1HPGD
SCHEMBL25215473 1.00 HSD17B10 (0.48) HSD17B10SMN1; SMN2NPC1ALDH1A1HPGD
SCHEMBL25418925 1.00 HSD17B10 (0.48) HSD17B10SMN1; SMN2NPC1ALDH1A1HPGD
SCHEMBL27308035 0.95 HSD17B10 (0.44) HSD17B10SMN1; SMN2NPC1ALDH1A1HPGD
SCHEMBL1977681 0.95 HSD17B10 (0.44) HSD17B10SMN1; SMN2NPC1ALDH1A1HPGD
SCHEMBL31048338 0.94 HPGD (0.46) HSD17B10SMN1; SMN2NPC1ALDH1A1HPGD
SCHEMBL25156692 0.90 HSD17B10 (0.40) HSD17B10SMN1; SMN2NPC1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118103369-A Pyridolactam derivatives, preparation method and application thereof 浙江海正药业股份有限公司 2024-05-28 CN disclosed
US-20180072723-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. 2018-03-15 US disclosed
US-20180072723-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. 2018-03-15 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-20180072723-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS HSD17B10 3889/4885SMN1; SMN2 4385/4885NPC1 1409/4885

“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.