SCHEMBL29844258

SCHEMBL29844258

COC(=O)C1CCC(n2ccc3c(cnn3COCC[Si](C)(C)C)c2=O)CC1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 2/20 0.36
▸ NPC1 O15118 1/20 0.33
▸ PDE1A P54750 2/20 0.32
▸ PDE1B Q01064 2/20 0.32
▸ PDE1C Q14123 2/20 0.32
▸ TP53 P04637 1/20 0.31
▸ KDM1A O60341 1/20 0.31
▸ KLKB1 P03952 1/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ WNT1 P04628 1/20 0.31
▸ GSK3B P49841 1/20 0.31
▸ DYRK1A Q13627 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ PDE7A Q13946 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ P2RX7 Q99572 1/20 0.30

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
SCHEMBL27186188 0.91 NPC1 (0.34) DGAT1NPC1KLKB1
SCHEMBL27186184 0.91 NPC1 (0.34) DGAT1NPC1KLKB1
SCHEMBL27186151 0.84 PDE1B (0.38) NPC1PDE1APDE1BPDE1C
SCHEMBL27186115 0.80 JAK1 (0.34) NPC1
SCHEMBL27186883 0.70 NPC1 (0.33) DGAT1NPC1
SCHEMBL27186123 0.70 PDE4B (0.35) PDE1APDE1BPDE1C
SCHEMBL29168362 0.69 MAP4K1 (0.38) KDM1AKDM4EALDH1A1GSK3BMEN1
SCHEMBL24783374 0.68 NPC1 (0.36) DGAT1NPC1KLKB1KDM4EALDH1A1
SCHEMBL29460036 0.68 NPC1 (0.36) DGAT1NPC1KLKB1KDM4EALDH1A1
SCHEMBL20746008 0.68 MAPT (0.38) DGAT1NPC1KLKB1KDM4EALDH1A1

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
US-20240109887-A1 NOVEL SUBSTITUTED BICYCLIC AZA-HETEROCYCLES AS SOS1 INHIBITORS VIVA STAR BIOSCIENCES (SUZHOU) CO., LTD. (CN) 2024-04-04 — — US disclosed
CN-117651701-A Novel substituted bicyclic aza heterocycles as SOS1 inhibitors 唯久生物技术(苏州)有限公司 2024-03-05 — — CN disclosed
WO-2022187266-A1 NOVEL SUBSTITUTED BICYCLI AZA-HETEROCYCLES AS SOS1 INHIBITORS VIVA STAR BIOSCIENCES (SUZHOU) CO., LTD. (CN) 2022-09-09 — — 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-20240109887-A1 NOVEL SUBSTITUTED BICYCLIC AZA-HETEROCYCLES AS SOS1 INHIBITORS SOS1, SOS2, KSR1 DGAT1 3718/4885NPC1 3158/4885PDE1A 1247/4885

“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.

Send feedback