SCHEMBL19633222

SCHEMBL19633222

C=CCOC(=O)Nc1ccc(CNC(=O)c2cc(N)cn2C)cc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ USP4 Q13107 1/20 0.39
▸ USP7 Q93009 1/20 0.39
▸ POLB P06746 3/20 0.37
▸ TP53 P04637 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ HPGD P15428 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ GAA P10253 2/20 0.37
▸ GFER P55789 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35

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
Hydrochloric Acid SCHEMBL30944564 0.89 MEN1 (0.41) POLBTP53THRBALDH1A1HPGD
SCHEMBL19633220 0.84 ERBB2 (0.40) USP4USP7POLBTP53ALDH1A1
SCHEMBL19633223 0.84 NAMPT (0.43) USP4USP7KDM4EL3MBTL1
SCHEMBL19636936 0.84 ERBB2 (0.40) USP4USP7POLBTP53ALDH1A1
Trifluoroacetic Acid SCHEMBL30944531 0.79 POLB (0.35) POLBTP53THRBSMN1; SMN2MEN1
SCHEMBL25855375 0.79 POLB (0.34) USP4USP7POLBTP53THRB
SCHEMBL19636845 0.77 ERBB2 (0.40) KDM4E
SCHEMBL19633055 0.77 NAMPT (0.38) MEN1KMT2AKDM4E
SCHEMBL19636934 0.77 ERBB2 (0.41) ALDH1A1HPGDSMN1; SMN2
SCHEMBL31615259 0.75 P2RY12 (0.44) POLBALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3458069-B1 PYRROLOBENZODIAZEPINES AND CONJUGATES THEREOF MERSANA THERAPEUTICS INC (US) 2023-07-05 — — EP disclosed
US-10660901-B2 Pyrrolobenzodiazepines and conjugates thereof MERSANA THERAPEUTICS, INC. (US) 2020-05-26 — — US disclosed
US-20190070194-A1 PYRROLOBENZODIAZEPINES AND CONJUGATES THEREOF MERSANA THERAPEUTICS, INC. 2019-03-07 — — US disclosed
US-20170333442-A1 PYRROLOBENZODIAZEPINES AND CONJUGATES THEREOF MERSANA THERAPEUTICS, INC. 2017-11-23 — — US disclosed
US-20170333442-A1 PYRROLOBENZODIAZEPINES AND CONJUGATES THEREOF MERSANA THERAPEUTICS, INC. 2017-11-23 — — 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-20170333442-A1 PYRROLOBENZODIAZEPINES AND CONJUGATES THEREOF CD79B, CLTB, FCGR3B USP4 2839/4885USP7 2915/4885POLB 861/4885
US-20190070194-A1 PYRROLOBENZODIAZEPINES AND CONJUGATES THEREOF CD79B, CLTB, FCGR3B USP4 2839/4885USP7 2915/4885POLB 861/4885
US-10660901-B2 Pyrrolobenzodiazepines and conjugates thereof CD79B, CLTB, FCGR3B USP4 2839/4885USP7 2915/4885POLB 861/4885

“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