SCHEMBL2295271

SCHEMBL2295271

CCOC(=O)C#Cc1ccc(-c2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.46
MAPT P10636 4/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
CYP1A1 P04798 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP1B1 Q16678 1/20 0.46
FFAR1 O14842 2/20 0.45
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
HPGD P15428 2/20 0.44
GAA P10253 2/20 0.43
ACACB O00763 1/20 0.43
TARBP2 Q15633 1/20 0.43
VCP P55072 1/20 0.41
NPSR1 Q6W5P4 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
GRM5 P41594 1/20 0.41

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
SCHEMBL852513 0.90 GAA (0.50) SMN1; SMN2FFAR1NPC1RAB9AGAA
SCHEMBL28747451 0.83 VCP (0.46) SMN1; SMN2MAPTCYP1A2FFAR1NPC1
SCHEMBL9935172 0.81 CA12 (0.50) SMN1; SMN2MAPTNPC1RAB9AGAA
SCHEMBL9934062 0.81 FFAR1 (0.59) SMN1; SMN2MAPTL3MBTL1FFAR1NPC1
SCHEMBL788820 0.80 APP (0.49) FFAR1GAAACACBALDH1A1
SCHEMBL2300644 0.80 ACACB (0.44) MAPTL3MBTL1FFAR1NPC1RAB9A
SCHEMBL2433672 0.80 APP (0.45) SMN1; SMN2MAPTCYP1A2FFAR1NPC1
SCHEMBL852379 0.80 L3MBTL1 (0.44) SMN1; SMN2MAPTL3MBTL1RAB9AKDM4E
SCHEMBL11544791 0.80 ALDH1A1 (0.53) L3MBTL1NPC1ACACBALDH1A1
SCHEMBL1977638 0.80 POLB (0.44) SMN1; SMN2MAPTL3MBTL1CYP1A2RAB9A

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-20260028554-A1 FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING AROMATIC DERIVATIVES OSMO LABS PBC (US) 2026-01-29 US disclosed
US-8003806-B2 Integrin antagonists useful as anticancer agents OSI Pharmaceuticals, LLC (US) 2011-08-23 US disclosed
EP-1828144-A2 INTEGRIN ANTAGONISTS USEFUL AS ANTICANCER AGENTS OSI Pharmaceuticals, Inc. (US) 2007-09-05 EP disclosed
US-20060116383-A1 Integrin antagonists useful as anticancer agents ALCATEL LUCENT (FR) 2006-06-01 US disclosed
WO-2006053342-A2 INTEGRIN ANTAGONISTS USEFUL AS ANTICANCER AGENTS OSI PHARMACEUTICALS, INC. (US) 2006-05-18 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 (2 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-20060116383-A1 Integrin antagonists useful as anticancer agents ITGB5, ITGA5, ITGB1 SMN1; SMN2 2159/4885MAPT 4745/4885L3MBTL1 1292/4885
US-20260028554-A1 FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING AROMATIC DERIVATIVES TAS2R42, TAS2R4, TAS2R41 SMN1; SMN2 3843/4885MAPT 4029/4885L3MBTL1 2468/4885

“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.