SCHEMBL16645050

SCHEMBL16645050

CC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](N)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ DPP7 Q9UHL4 3/20 0.41
▸ DPP4 P27487 2/20 0.41
▸ DPP8 Q6V1X1 2/20 0.41
▸ DPP9 Q86TI2 2/20 0.41
▸ FAP Q12884 1/20 0.39
▸ SIRT5 Q9NXA8 2/20 0.38
▸ C3AR1 Q16581 1/20 0.36
▸ SIRT6 Q8N6T7 1/20 0.35
▸ SIRT1 Q96EB6 1/20 0.35
▸ NOD1 Q9Y239 1/20 0.35
▸ NPY4R P50391 6/20 0.35
▸ NPY1R P25929 4/20 0.35
▸ NPY2R P49146 3/20 0.35
▸ NPY5R Q15761 3/20 0.35
▸ KISS1R Q969F8 2/20 0.34
▸ ECE1 P42892 1/20 0.32

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
SCHEMBL25448049 1.00 DPP7 (0.41) DPP7DPP4DPP8DPP9FAP
SCHEMBL14887421 1.00 DPP7 (0.41) DPP7DPP4DPP8DPP9FAP
SCHEMBL22848364 0.93 DPP4 (0.42) DPP7DPP4DPP8DPP9FAP
SCHEMBL20795868 0.93 DPP4 (0.42) DPP7DPP4DPP8DPP9FAP
SCHEMBL22797764 0.93 DPP4 (0.42) DPP7DPP4DPP8DPP9FAP
SCHEMBL28234596 0.93 DPP4 (0.42) DPP7DPP4DPP8DPP9FAP
SCHEMBL20428137 0.89 NPY4R (0.44) DPP7DPP4DPP8DPP9FAP
SCHEMBL29359380 0.88 C3AR1 (0.46) DPP7DPP4DPP8DPP9FAP
SCHEMBL16862522 0.88 C3AR1 (0.46) DPP7DPP4DPP8DPP9FAP
SCHEMBL28819908 0.88 C3AR1 (0.46) DPP7DPP4DPP8DPP9FAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3054992-B1 PROTEIN-POLYMER-DRUG CONJUGATES ASANA BIOSCIENCES LLC (US) 2019-08-14 — — EP disclosed
EP-3054991-B1 PROTEIN-POLYMER-DRUG CONJUGATES MERSANA THERAPEUTICS INC (US) 2019-04-03 — — EP disclosed
US-9849191-B2 Protein-polymer-drug conjugates MERSANA THERAPEUTICS, INC. (US) 2017-12-26 — — US disclosed
US-9822112-B2 Heteroarylene-bridged benzodiazepine dimers, conjugates thereof, and methods of making and using BRISTOL-MEYERS SQUIBB COMPANY (US) 2017-11-21 — — US disclosed
US-20170233392-A1 HETEROARYLENE-BRIDGED BENZODIAZEPINE DIMERS, CONJUGATES THEREOF, AND METHODS OF MAKING AND USING BRISTOL-MYERS SQUIBB COMPANY 2017-08-17 — — US disclosed
US-9676775-B2 Heteroarylene-bridged benzodiazepine dimers, conjugates thereof, and methods of making and using BRISTOL-MYERS SQUIBB COMPANY (US) 2017-06-13 — — US disclosed
US-9526801-B2 Heteroarylene-bridged benzodiazepine dimers, conjugates thereof, and methods of making and using BRISTOL-MYERS SQUIBB COMPANY (US) 2016-12-27 — — US disclosed
US-20160199510-A1 HETEROARYLENE-BRIDGED BENZODIAZEPINE DIMERS, CONJUGATES THEREOF, AND METHODS OF MAKING AND USING BRISTOL-MYERS SQUIBB COMPANY 2016-07-14 — — US disclosed
US-20150125474-A1 PROTEIN-POLYMER-DRUG CONJUGATES MERSANA THERAPEUTICS, INC. 2015-05-07 — — US disclosed
WO-2015054669-A1 PROTEIN-POLYMER-DRUG CONJUGATES ASANA BIOSCIENCES, LLC (US) 2015-04-16 — — WO disclosed
WO-2015054659-A1 PROTEIN-POLYMER-DRUG CONJUGATES MERSANA THERAPEUTICS, INC. (US) 2015-04-16 — — WO disclosed
US-20150104407-A1 PROTEIN-POLYMER-DRUG CONJUGATES MERSANA THERAPEUTICS, INC. 2015-04-16 — — 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 (4 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-20150104407-A1 PROTEIN-POLYMER-DRUG CONJUGATES PBRM1, STAMBP, TSPO DPP7 3148/4885DPP4 3823/4885DPP8 3371/4885
US-20160199510-A1 HETEROARYLENE-BRIDGED BENZODIAZEPINE DIMERS, CONJUGATES THEREOF, AND METHODS OF MAKING AND USING GABRA1, GABRA2, GABRA3 DPP7 4524/4885DPP4 4708/4885DPP8 4041/4885
US-20170233392-A1 HETEROARYLENE-BRIDGED BENZODIAZEPINE DIMERS, CONJUGATES THEREOF, AND METHODS OF MAKING AND USING GABRA1, GABRA2, GABRA3 DPP7 4524/4885DPP4 4708/4885DPP8 4041/4885
US-20150125474-A1 PROTEIN-POLYMER-DRUG CONJUGATES PBRM1, STAMBP, TSPO DPP7 3148/4885DPP4 3823/4885DPP8 3371/4885

“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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