SCHEMBL22472935

SCHEMBL22472935

COC(=O)N1C(C)CC(N2CCC(C(=O)N3CCCCCC3)CC2)CC1C

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
ALDH1A1 P00352 7/20 0.41
KMT2A Q03164 2/20 0.41
LMNA P02545 2/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.39
HSP90AA1 P07900 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL22472905 0.87 ALDH1A1 (0.53) HPGDSMN1; SMN2ALDH1A1KMT2ALMNA
SCHEMBL22472933 0.84 HPGD (0.44) HPGDSMN1; SMN2ALDH1A1KMT2ALMNA
SCHEMBL22472937 0.75 CHRM1 (0.55) LMNAPOLB
SCHEMBL22472869 0.75 MAPT (0.45) SMN1; SMN2POLB
SCHEMBL22472880 0.75 MMP13 (0.35) SMN1; SMN2ALDH1A1KMT2A
SCHEMBL22472879 0.74 EPHX2 (0.39) HPGDSMN1; SMN2ALDH1A1KMT2ALMNA
SCHEMBL22472924 0.73 MMP13 (0.36) SMN1; SMN2ALDH1A1KMT2A
SCHEMBL21597933 0.72 ALDH1A1 (0.50) HPGDALDH1A1KMT2ALMNAMEN1
SCHEMBL22472940 0.72 CYP2C9 (0.41) ALDH1A1KMT2AMEN1TSHR
SCHEMBL27176073 0.69 HPGD (0.47) HPGDSMN1; SMN2ALDH1A1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10787447-B2 Pharmaceutical compounds HEPTARES THERAPEUTICS LIMITED (GB) 2020-09-29 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-10787447-B2 Pharmaceutical compounds CHRM1, CHRM2, CHRM4 HPGD 2702/4885SMN1; SMN2 2514/4885ALDH1A1 2016/4885

“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.