SCHEMBL15161359

SCHEMBL15161359

Nc1ncc(C(=O)NC(CO)CNC(=O)NC2CC2)c2ccc(-c3cccc(F)c3)cc12

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 13/20 0.71
NPR1 P16066 7/20 0.44

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
SCHEMBL15161328 0.87 MAP4K4 (0.61) MAP4K4
SCHEMBL18595984 0.87 MAP4K4 (0.66) MAP4K4NPR1
SCHEMBL15161422 0.87 MAP4K4 (0.67) MAP4K4
SCHEMBL15161444 0.84 MAP4K4 (1.00) MAP4K4
SCHEMBL16240624 0.81 MAP4K4 (0.60) MAP4K4
SCHEMBL15161430 0.80 MAP4K4 (0.92) MAP4K4
SCHEMBL15161412 0.80 MAP4K4 (0.92) MAP4K4
SCHEMBL15161396 0.80 MAP4K4 (0.92) MAP4K4
SCHEMBL21003812 0.79 MAP4K4 (0.90) MAP4K4
SCHEMBL15161342 0.78 MAP4K4 (0.86) MAP4K4

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-20230020356-A1 METHODS OF STRATIFYING AND TREATING A SUB-POPULATION OF INFLAMMATORY BOWEL DISEASE PATIENTS CEDARS-SINAI MEDICAL CENTER 2023-01-19 US disclosed
EP-2809652-B1 ISOQUINOLINE AND NAPHTHYRIDINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2019-05-15 EP disclosed
EP-2809652-B1 ISOQUINOLINE AND NAPHTHYRIDINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2019-05-15 EP disclosed
US-9586956-B2 Isoquinoline and naphthyridine derivatives GENENTECH, INC. (US) 2017-03-07 US disclosed
US-9586956-B2 Isoquinoline and naphthyridine derivatives GENENTECH, INC. (US) 2017-03-07 US disclosed
US-9586956-B2 Isoquinoline and naphthyridine derivatives GENENTECH, INC. (US) 2017-03-07 US disclosed
US-20140343036-A1 ISOQUINOLINE AND NAPHTHYRIDINE DERIVATIVES GENENTECH, INC. (US) 2014-11-20 US disclosed
US-20140343036-A1 ISOQUINOLINE AND NAPHTHYRIDINE DERIVATIVES GENENTECH, INC. (US) 2014-11-20 US disclosed
US-20140343036-A1 ISOQUINOLINE AND NAPHTHYRIDINE DERIVATIVES GENENTECH, INC. (US) 2014-11-20 US disclosed
WO-2013113669-A1 ISOQUINOLINE AND NAPHTHYRIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2013-08-08 WO 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-20140343036-A1 ISOQUINOLINE AND NAPHTHYRIDINE DERIVATIVES NQO1, NDUFC2, NDUFV2 MAP4K4 904/4885NPR1 2629/4885

“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.