SCHEMBL7482990

SCHEMBL7482990

C1=CC2=NC1=CC1=NC(=CC3=NC(=CC4=NC(=C2)C=C4)C(c2nccs2)=C3c2nccs2)C=C1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PDPK1 O15530 1/20 0.30

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
SCHEMBL27479528 0.77 PDPK1 (0.32) PDPK1
SCHEMBL11326008 0.75 PDPK1 (0.31) PDPK1
SCHEMBL5576466 0.71 KDM4E (0.31) —
SCHEMBL7538292 0.69 — —
SCHEMBL5013694 0.65 — —
SCHEMBL28049799 0.65 SENP1 (0.30) —
SCHEMBL27957510 0.65 — —
SCHEMBL225879 0.64 ALDH1A1 (0.32) —
SCHEMBL80003 0.63 — —
SCHEMBL9754335 0.63 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1155019-A4 SUBSTITUTED PORPHYRINS NAT JEWISH MED & RES CENTER (US) 2002-07-03 — — EP disclosed
EP-1155019-A1 SUBSTITUTED PORPHYRINS National Jewish Medical and Research Center (US) 2001-11-21 — — EP disclosed
WO-2000043395-A1 SUBSTITUTED PORPHYRINS NATIONAL JEWISH MEDICAL AND RESEARCH CENTER (US) 2000-07-27 — — WO disclosed
Send feedback