SCHEMBL18924152

SCHEMBL18924152

COC(=O)CCCCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)OCC(C)C)C(C)C

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.36
ALDH1A1 P00352 1/20 0.35
CASP1 P29466 1/20 0.35
LMNA P02545 1/20 0.35
RECQL P46063 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
SCHEMBL18924154 0.83 FAAH (0.43) TSHRALDH1A1CASP1LMNARECQL
SCHEMBL17570945 0.83 FAAH (0.43) TSHRALDH1A1CASP1LMNARECQL
SCHEMBL19656347 0.83 PSENEN (0.40) TSHRCASP1RECQL
SCHEMBL6444837 0.79 EPHX2 (0.44) TSHRALDH1A1RECQL
SCHEMBL28806410 0.78 TSHR (0.47) TSHRALDH1A1LMNARECQL
SCHEMBL6446232 0.75 EPHX2 (0.48) TSHRALDH1A1RECQL
SCHEMBL22064141 0.75 METAP2 (0.35) TSHRALDH1A1
SCHEMBL622468 0.75 EPHX2 (0.48) TSHRALDH1A1RECQL
SCHEMBL621624 0.74 EPHX2 (0.50) TSHRALDH1A1LMNARECQL
SCHEMBL621625 0.74 EPHX2 (0.50) TSHRALDH1A1LMNARECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230233697-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2023-07-27 US disclosed
US-11116845-B2 Cytotoxic benzodiazepine derivatives IMMUNOGEN, INC. (US) 2021-09-14 US disclosed
EP-3778601-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES ImmunoGen, Inc. (US) 2021-02-17 EP disclosed
US-20200405870-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2020-12-31 US disclosed
US-10722588-B2 Cytotoxic benzodiazepine derivatives IMMUNOGEN, INC. (US) 2020-07-28 US disclosed
EP-3189056-B1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN INC (US) 2020-06-10 EP disclosed
US-20190269786-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2019-09-05 US disclosed
US-10238751-B2 Cytotoxic benzodiazepine derivatives IMMUNOGEN, INC. (US) 2019-03-26 US disclosed
US-20170340748-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2017-11-30 US disclosed
US-9669102-B2 Cytotoxic benzodiazepine derivatives IMMUNOGEN, INC. (US) 2017-06-06 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 (7 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-10238751-B2 Cytotoxic benzodiazepine derivatives GABRA6, GABBR1, GABRA5 TSHR 889/4885ALDH1A1 695/4885CASP1 1683/4885
US-11116845-B2 Cytotoxic benzodiazepine derivatives GABRA6, GABBR1, GABRA5 TSHR 889/4885ALDH1A1 695/4885CASP1 1683/4885
US-20200405870-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES GABRA6, GABBR1, GABRA5 TSHR 889/4885ALDH1A1 695/4885CASP1 1683/4885
US-20230233697-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES GABRA6, GABBR1, GABRA5 TSHR 889/4885ALDH1A1 695/4885CASP1 1683/4885
US-10722588-B2 Cytotoxic benzodiazepine derivatives GABRA6, GABBR1, GABRA5 TSHR 889/4885ALDH1A1 695/4885CASP1 1683/4885
US-20190269786-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES GABRA6, GABBR1, GABRA5 TSHR 889/4885ALDH1A1 695/4885CASP1 1683/4885
US-20170340748-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES GABRA6, GABBR1, GABRA5 TSHR 889/4885ALDH1A1 695/4885CASP1 1683/4885

“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.