SCHEMBL25602002

SCHEMBL25602002

CCCCOc1cc(CC(=O)OCC)on1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 2/20 0.47
ALDH1A1 P00352 4/20 0.43
TSHR P16473 2/20 0.43
TP53 P04637 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
TDP1 Q9NUW8 2/20 0.41
MAPK1 P28482 1/20 0.40
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CYP19A1 P11511 1/20 0.39
L3MBTL1 Q9Y468 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
SCHEMBL25601889 0.82 KLK7 (0.41) ALDH1A1SMN1; SMN2
SCHEMBL25930328 0.80 TSHR (0.40) ALDH1A1TSHRTP53SMN1; SMN2TDP1
SCHEMBL24838097 0.80 SMPD1 (0.47) SMPD1ALDH1A1SMN1; SMN2MAPK1CYP1A2
SCHEMBL19600796 0.79 PPARA (0.44) ALDH1A1TSHRTP53SMN1; SMN2TDP1
SCHEMBL25603628 0.79 PPARA (0.52) ALDH1A1TSHRSMN1; SMN2TDP1MAPK1
SCHEMBL10194129 0.77 SMPD1 (0.51) SMPD1ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL4751904 0.77 VHL (0.54) ALDH1A1SMN1; SMN2TDP1KDM4E
SCHEMBL14228524 0.77 SMPD1 (0.47) SMPD1ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL19598756 0.75 PPARA (0.45) ALDH1A1TSHRSMN1; SMN2TDP1PPARA
SCHEMBL16705452 0.75 SMN1; SMN2 (0.42) ALDH1A1SMN1; SMN2KDM4E

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-20230173078-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-06-08 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-20230173078-A1 SMARCA DEGRADERS AND USES THEREOF SMARCA1, SMARCA2, SMARCC2 SMPD1 1813/4885ALDH1A1 2230/4885TSHR 4388/4885

“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.