SCHEMBL29923989

SCHEMBL29923989

CCCCOC(=O)N1CCC(C)(C=O)C1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
LMNA P02545 1/20 0.49
POLB P06746 1/20 0.49
OPRD1 P41143 1/20 0.38
OPRK1 P41145 1/20 0.38
ATM Q13315 1/20 0.38
ALDH1A1 P00352 4/20 0.36
HPGD P15428 2/20 0.36
TSHR P16473 2/20 0.36
HRH2 P25021 2/20 0.36
HRH1 P35367 2/20 0.36
HCAR2 Q8TDS4 1/20 0.34
BCHE P06276 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
EPHX1 P07099 1/20 0.32
KDM4E B2RXH2 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GBA2 Q9HCG7 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL30135752 0.91 POLB (0.55) SMN1; SMN2LMNAPOLBOPRD1OPRK1
SCHEMBL30732546 0.79 SMN1; SMN2 (0.51) SMN1; SMN2LMNAPOLBOPRD1OPRK1
SCHEMBL15569374 0.78 POLB (0.50) SMN1; SMN2LMNAPOLBOPRD1OPRK1
SCHEMBL15569373 0.78 POLB (0.50) SMN1; SMN2LMNAPOLBOPRD1OPRK1
SCHEMBL4368186 0.78 SMN1; SMN2 (0.53) SMN1; SMN2LMNAPOLBOPRD1OPRK1
SCHEMBL30075831 0.77 SMN1; SMN2 (0.49) SMN1; SMN2LMNAPOLBOPRD1OPRK1
SCHEMBL31386109 0.77 POLB (0.52) SMN1; SMN2LMNAPOLBOPRD1OPRK1
SCHEMBL1269471 0.77 TSHR (0.49) SMN1; SMN2LMNAPOLBATMALDH1A1
SCHEMBL12328494 0.76 POLB (0.51) SMN1; SMN2LMNAPOLBOPRD1OPRK1
SCHEMBL27842859 0.76 POLB (0.58) SMN1; SMN2LMNAPOLBOPRD1OPRK1

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
US-12435046-B2 Alkynyl quinazoline compounds BLACK DIAMOND THERAPEUTICS, INC. (US) 2025-10-07 US disclosed
US-20220298120-A1 ALKYNYL QUINAZOLINE COMPOUNDS BLACK DIAMOND THERAPEUTICS, INC. 2022-09-22 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 (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-12435046-B2 Alkynyl quinazoline compounds GLS, GLS2, MCL1 SMN1; SMN2 206/4885LMNA 557/4885POLB 595/4885
US-20220298120-A1 ALKYNYL QUINAZOLINE COMPOUNDS GLS, GLS2, MCL1 SMN1; SMN2 206/4885LMNA 557/4885POLB 595/4885

“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.