SCHEMBL19915462

SCHEMBL19915462

C=CC(=O)NCCN(CCNC(=O)/C=C/C(=O)O)C(=O)CCC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.42
▸ TAAR1 Q96RJ0 6/20 0.38
▸ TSHR P16473 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ ZDHHC20 Q5W0Z9 1/20 0.34
▸ ZDHHC2 Q9UIJ5 1/20 0.34
▸ LMNA P02545 2/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33

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
SCHEMBL19911192 0.91 ALDH1A1 (0.41) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL19915461 0.84 ALDH1A1 (0.35) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL19911209 0.83 ALDH1A1 (0.38) ALDH1A1TAAR1TSHRMAPK1TDP1
SCHEMBL21851257 0.81 ALDH1A1 (0.50) ALDH1A1TAAR1TSHRMAPK1TDP1
SCHEMBL20159780 0.77 ZDHHC20 (0.46) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL20194268 0.73 ALDH1A1 (0.38) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL20061012 0.73 ALDH1A1 (0.38) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL21836734 0.72 ALDH1A1 (0.52) ALDH1A1TAAR1TSHRLMNACYP2D6
SCHEMBL543785 0.72 ALDH1A1 (0.52) ALDH1A1TAAR1TSHRLMNACYP2D6
SCHEMBL543786 0.72 ALDH1A1 (0.52) ALDH1A1TAAR1TSHRLMNACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10772965-B2 Covalent linkers in antibody-drug conjugates and methods of making and using the same RC BIOTECHNOLOGIES, INC. (US) 2020-09-15 — — US disclosed
US-20180169250-A1 COVALENT LINKERS IN ANTIBODY-DRUG CONJUGATES AND METHODS OF MAKING AND USING THE SAME REMEGEN CO., LTD. (CN) 2018-06-21 — — US disclosed
US-20180055948-A1 Covalent Linkers in Antibody-Drug Conjugates and Methods of Making and Using the Same REMEGEN CO., LTD. (CN) 2018-03-01 — — 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 (3 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-20180169250-A1 COVALENT LINKERS IN ANTIBODY-DRUG CONJUGATES AND METHODS OF MAKING AND USING THE SAME DHFR, FCGR1A, ADCY4 ALDH1A1 211/4885TAAR1 2738/4885TSHR 624/4885
US-20180055948-A1 Covalent Linkers in Antibody-Drug Conjugates and Methods of Making and Using the Same DHFR, FCGR1A, ADCY4 ALDH1A1 211/4885TAAR1 2738/4885TSHR 624/4885
US-10772965-B2 Covalent linkers in antibody-drug conjugates and methods of making and using the same DHFR, FCGR1A, ADCY4 ALDH1A1 211/4885TAAR1 2738/4885TSHR 624/4885

“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.

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