SCHEMBL19739092

SCHEMBL19739092

COc1ccc2[nH]c(-c3ccc(NC(=O)OC(C)(C)C)cc3)nc2c1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.50
▸ TP53 P04637 2/20 0.50
▸ MAPT P10636 2/20 0.50
▸ HPSE Q9Y251 6/20 0.49
▸ KDR P35968 1/20 0.47
▸ ALDH1A1 P00352 3/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ PKM P14618 2/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ COMT P21964 1/20 0.45

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
SCHEMBL19739152 0.86 SMN1; SMN2 (0.55) SMN1; SMN2TP53MAPTHPSEALDH1A1
SCHEMBL30045266 0.86 MAPT (0.51) SMN1; SMN2TP53MAPTHPSEALDH1A1
SCHEMBL5190823 0.83 KDM4E (0.53) SMN1; SMN2TP53MAPTHPSEALDH1A1
SCHEMBL19739335 0.82 MMP2 (0.53) SMN1; SMN2TP53MAPTALDH1A1NPC1
SCHEMBL6529336 0.81 HPSE (0.73) SMN1; SMN2HPSEALDH1A1NPC1PKM
SCHEMBL30045333 0.80 TP53 (0.47) SMN1; SMN2TP53MAPTHPSEALDH1A1
SCHEMBL6528731 0.79 HPSE (0.61) HPSEALDH1A1KDM4EPOLBHPGD
SCHEMBL19753933 0.78 TP53 (0.61) SMN1; SMN2TP53MAPTHPSEALDH1A1
SCHEMBL14381770 0.78 COMT (0.66) SMN1; SMN2TP53MAPTHPSENPC1
SCHEMBL3978246 0.77 CYP17A1 (0.58) SMN1; SMN2TP53ALDH1A1NPC1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3475284-B1 PYRROLOBENZODIAZEPINES AND CONJUGATES THEREOF MERSANA THERAPEUTICS INC (US) 2022-11-02 — — EP disclosed
EP-3475284-A1 PYRROLOBENZODIAZEPINES AND CONJUGATES THEREOF Mersana Therapeutics, Inc. (US) 2019-05-01 — — EP disclosed
WO-2017223275-A1 PYRROLOBENZODIAZEPINES AND CONJUGATES THEREOF MERSANA THERAPEUTICS, INC. (US) 2017-12-28 — — WO disclosed
US-20170369453-A1 PYRROLOBENZODIAZEPINES AND CONJUGATES THEREOF MERSANA THERAPEUTICS, INC. 2017-12-28 — — 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-20170369453-A1 PYRROLOBENZODIAZEPINES AND CONJUGATES THEREOF CD79B, CLTB, FCGR3B SMN1; SMN2 2865/4885TP53 595/4885MAPT 709/4885

“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