SCHEMBL25130174

SCHEMBL25130174

CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2cc3c(NC(C)C)cccc3nc2-1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 17/20 0.78
▸ GLA P06280 4/20 0.77
▸ SMN1; SMN2 Q16637 3/20 0.77
▸ ALDH1A1 P00352 3/20 0.77
▸ RECQL P46063 2/20 0.77
▸ TDP1 Q9NUW8 2/20 0.77
▸ MEN1 O00255 2/20 0.77
▸ KMT2A Q03164 2/20 0.77
▸ KDM4E B2RXH2 4/20 0.76
▸ POLB P06746 2/20 0.76
▸ MAPT P10636 2/20 0.76
▸ HIF1A Q16665 2/20 0.76
▸ HSD17B10 Q99714 2/20 0.76
▸ RXFP1 Q9HBX9 2/20 0.76
▸ NPC1 O15118 1/20 0.76
▸ PAX8 Q06710 1/20 0.76
▸ L3MBTL1 Q9Y468 1/20 0.76
▸ NCOA3 Q9Y6Q9 1/20 0.76
▸ RAB9A P51151 2/20 0.75
▸ BLM P54132 2/20 0.75

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
SCHEMBL27432679 0.92 TOP1 (0.75) TOP1GLASMN1; SMN2ALDH1A1RECQL
SCHEMBL5323807 0.91 TOP1 (0.81) TOP1GLASMN1; SMN2ALDH1A1RECQL
SCHEMBL22893112 0.90 TOP1 (0.79) TOP1GLASMN1; SMN2ALDH1A1RECQL
SCHEMBL27432677 0.89 TOP1 (0.77) TOP1GLASMN1; SMN2ALDH1A1RECQL
SCHEMBL7633084 0.89 TOP1 (0.77) TOP1GLASMN1; SMN2ALDH1A1RECQL
SCHEMBL17077988 0.89 TOP1 (0.78) TOP1GLASMN1; SMN2ALDH1A1RECQL
SCHEMBL8078009 0.89 TOP1 (0.81) TOP1GLASMN1; SMN2ALDH1A1RECQL
SCHEMBL7629235 0.89 TOP1 (0.84) TOP1GLASMN1; SMN2ALDH1A1RECQL
SCHEMBL7631826 0.88 TOP1 (0.83) TOP1GLASMN1; SMN2ALDH1A1RECQL
SCHEMBL7626877 0.88 TOP1 (0.81) TOP1GLASMN1; SMN2ALDH1A1RECQL

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-20230115871-A1 A CONJUGATE OF A CYTOTOXIC AGENT TO A CELL BINDING MOLECULE WITH BRANCHED LINKERS HANGZHOU DAC BIOTECH CO., LTD (CN) 2023-04-13 — — 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-20230115871-A1 A CONJUGATE OF A CYTOTOXIC AGENT TO A CELL BINDING MOLECULE WITH BRANCHED LINKERS CD2BP2, EPCAM, CD74 TOP1 174/4885GLA 2807/4885SMN1; SMN2 2840/4885

“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.

Send feedback