SCHEMBL10171465

SCHEMBL10171465

CCC(C)(CC)COC(C)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.48
LMNA P02545 3/20 0.48
HSD17B10 Q99714 2/20 0.48
TSHR P16473 4/20 0.39
CHRM5 P08912 2/20 0.34
CHRM1 P11229 2/20 0.34
CHRM3 P20309 2/20 0.34
GAA P10253 2/20 0.34
PGR P06401 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
HTR1A P08908 1/20 0.34
CHRNB2 P17787 1/20 0.34
TBXA2R P21731 1/20 0.34
CHRNB4 P30926 1/20 0.34
CHRNA3 P32297 1/20 0.34
CHRNA7 P36544 1/20 0.34
CHRNA4 P43681 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CHRNA10 Q9GZZ6 1/20 0.34

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
SCHEMBL15024590 0.95 ALDH1A1 (0.48) ALDH1A1LMNAHSD17B10TSHRCHRM5
SCHEMBL14076148 0.89 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10TSHRCHRM5
SCHEMBL3199088 0.87 ALDH1A1 (0.48) ALDH1A1LMNAHSD17B10TSHRCHRM5
SCHEMBL15542597 0.87 LMNA (0.57) ALDH1A1LMNAHSD17B10TSHRCHRM5
SCHEMBL15542343 0.83 ALDH1A1 (0.47) ALDH1A1LMNAHSD17B10TSHRGAA
SCHEMBL16470989 0.82 ALDH1A1 (0.37) ALDH1A1LMNAHSD17B10TSHRSMN1; SMN2
SCHEMBL12656304 0.82 ALDH1A1 (0.37) ALDH1A1LMNAHSD17B10TSHRGAA
SCHEMBL14727727 0.81 LMNA (0.61) ALDH1A1LMNAHSD17B10TSHRCHRM5
SCHEMBL8317472 0.80 LMNA (0.42) ALDH1A1LMNAHSD17B10TSHRRAB9A
SCHEMBL11514847 0.80 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10TSHRCHRM5

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-8507569-B2 Photoresist compositions BASF SE (DE) 2013-08-13 US disclosed
US-20120038996-A1 PHOTORESIST COMPOSITIONS BASF SE (DE) 2012-02-16 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-20120038996-A1 PHOTORESIST COMPOSITIONS HAAO, CBR3, AKR1B10 ALDH1A1 99/4885LMNA 1013/4885HSD17B10 77/4885

“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.