SCHEMBL31162452

SCHEMBL31162452

C=CC(=O)Nc1cccc(C)c1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
HSD17B10 Q99714 3/20 0.51
HTT P42858 2/20 0.51
LMNA P02545 1/20 0.51
TP53 P04637 1/20 0.51
TSHR P16473 1/20 0.51
BTK Q06187 4/20 0.50
ATM Q13315 1/20 0.50
HDAC3 O15379 1/20 0.50
HDAC4 P56524 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC11 Q96DB2 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
HDAC9 Q9UKV0 1/20 0.50
HDAC5 Q9UQL6 1/20 0.50

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
SCHEMBL17931668 1.00 NPC1 (0.51) NPC1RAB9AHSD17B10HTTLMNA
Acrylamide SCHEMBL27510817 0.94 BTK (0.52) NPC1RAB9AHSD17B10HTTLMNA
SCHEMBL648951 0.85 NPC1 (0.62) NPC1RAB9AHSD17B10HTTLMNA
SCHEMBL11508899 0.84 FGFR4 (0.50) BTKTGM2
SCHEMBL7191119 0.84 BTK (0.49) NPC1RAB9AHSD17B10HTTLMNA
SCHEMBL25289986 0.83 MAPT (0.61) HTTLMNATSHRMAPTALDH1A1
SCHEMBL19279109 0.83 TGM2 (0.49) LMNABTKALDH1A1POLBTGM2
SCHEMBL21287459 0.83 TGM2 (0.46) NPC1RAB9ABTKTGM2
SCHEMBL29410377 0.83 MAPT (0.61) HTTLMNATSHRMAPTALDH1A1
SCHEMBL25294216 0.83 SMN1; SMN2 (0.55) NPC1RAB9ABTKALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118955381-A Pyrazole compound as well as preparation method and application thereof 赣南师范大学 2024-11-15 CN claimed
CN-113164495-B Covalent targeting of E3 ligases 加利福尼亚大学董事会 2025-04-22 CN disclosed
US-20250120982-A1 COVALENT TARGETING OF E3 LIGASES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2025-04-17 US disclosed
CN-118955381-A Pyrazole compound as well as preparation method and application thereof 赣南师范大学 2024-11-15 CN 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-20250120982-A1 COVALENT TARGETING OF E3 LIGASES STUB1, XIAP, RBX1 NPC1 2206/4885RAB9A 2030/4885HSD17B10 2409/4885

“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.