SCHEMBL11307834

SCHEMBL11307834

Cc1cc2nc3c(=O)n(C)c(=O)nc-3n(C=O)c2cc1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ GLA P06280 1/20 0.48
▸ HPGD P15428 1/20 0.48
▸ GSR P00390 9/20 0.44
▸ TDP2 O95551 7/20 0.41
▸ MAPT P10636 3/20 0.41
▸ BLM P54132 3/20 0.41
▸ KDM4C Q9H3R0 3/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ KDM4A O75164 2/20 0.41
▸ ABL1 P00519 2/20 0.41
▸ LMNA P02545 2/20 0.41
▸ TP53 P04637 2/20 0.41
▸ POLB P06746 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ GALK1 P51570 2/20 0.41
▸ RIN1 Q13671 2/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41

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
SCHEMBL14399199 0.84 SMN1; SMN2 (0.58) SMN1; SMN2KDM4EALDH1A1GLAHPGD
SCHEMBL27033894 0.78 KDM4E (0.48) SMN1; SMN2KDM4EALDH1A1GLAHPGD
SCHEMBL11307978 0.76 TDP2 (0.40) SMN1; SMN2KDM4EALDH1A1HPGDGSR
SCHEMBL11304574 0.76 GSR (0.45) SMN1; SMN2KDM4EALDH1A1GSRTDP2
SCHEMBL16476446 0.74 KDM4E (0.43) SMN1; SMN2KDM4EALDH1A1GLAHPGD
SCHEMBL19415772 0.74 KDM4E (0.43) SMN1; SMN2KDM4EALDH1A1GLAHPGD
Iodide SCHEMBL17254512 0.73 KDM4E (0.43) SMN1; SMN2KDM4EALDH1A1GLAHPGD
SCHEMBL14212581 0.72 KDM4E (0.48) SMN1; SMN2KDM4EALDH1A1GLAHPGD
SCHEMBL864708 0.70 KDM4E (0.43) SMN1; SMN2KDM4EALDH1A1GLAHPGD
SCHEMBL14369939 0.69 KDM4E (0.51) SMN1; SMN2KDM4EALDH1A1GLAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0030550-A1 ANTIHYPERTENSIVE AGENTS AND THEIR USE IN TREATMENT OF HYPERTENSION TRACHEWSKY, Daniel (US) 1981-06-24 — — EP claimed
US-4264601-A SUBSTITUTED ISOALLOXAZINES THE BOARD OF REGENTS OF THE UNIVERSITY OF OKLAHOMA (US) 1981-04-28 — — US claimed
WO-1980002799-A1 ANTIHYPERTENSIVE AGENTS AND THEIR USE IN TREATMENT OF HYPERTENSION TRACHEWSKY D 1980-12-24 — — WO claimed
EP-0030550-A1 ANTIHYPERTENSIVE AGENTS AND THEIR USE IN TREATMENT OF HYPERTENSION TRACHEWSKY, Daniel (US) 1981-06-24 — — EP disclosed
US-4264601-A SUBSTITUTED ISOALLOXAZINES THE BOARD OF REGENTS OF THE UNIVERSITY OF OKLAHOMA (US) 1981-04-28 — — US disclosed
WO-1980002799-A1 ANTIHYPERTENSIVE AGENTS AND THEIR USE IN TREATMENT OF HYPERTENSION TRACHEWSKY D 1980-12-24 — — WO disclosed
Send feedback