SCHEMBL31216751

SCHEMBL31216751

c1ccc2nnc(C3CCOC3)cc2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
OPRK1 P41145 3/20 0.35
PDE10A Q9Y233 4/20 0.35
PIM1 P11309 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GLA P06280 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
ACHE P22303 1/20 0.34
MAPK1 P28482 2/20 0.32
LRRK2 Q5S007 1/20 0.32
PDE1A P54750 1/20 0.32
PDE1B Q01064 1/20 0.32
PDE1C Q14123 1/20 0.32
PDE4D Q08499 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
PIK3CD O00329 1/20 0.32
PIK3CA P42336 1/20 0.32
NPC1 O15118 1/20 0.32

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
SCHEMBL31184088 0.76 MAPK1 (0.39) KDM4EPDE10APIM1ALDH1A1MAPT
SCHEMBL29733076 0.74 MEN1 (0.50) KDM4EACHENPC1RAB9A
Hydrochloric Acid SCHEMBL29733086 0.73 MEN1 (0.49) KDM4EACHENPC1RAB9A
Hydrochloric Acid SCHEMBL29733079 0.73 MEN1 (0.49) KDM4EACHENPC1RAB9A
Hydrochloric Acid SCHEMBL29733077 0.73 MEN1 (0.49) KDM4EACHENPC1RAB9A
SCHEMBL30824523 0.72 NPC1 (0.41) KDM4EOPRK1PDE10AALDH1A1MAPT
SCHEMBL30824475 0.72 NPC1 (0.41) KDM4EOPRK1PDE10AALDH1A1MAPT
SCHEMBL15819218 0.72 PDE10A (0.35) PDE10A
SCHEMBL24835923 0.72 NPC1 (0.44) PDE10APIM1ALDH1A1PDE1APDE1B
SCHEMBL30367774 0.69 CYP1A2 (0.44) PIK3CDPIK3CACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240368170-A1 CINNOLINE COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2024-11-07 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-20240368170-A1 CINNOLINE COMPOUNDS AND USES THEREOF HIPK1, CDC7, MAP3K7 KDM4E 3429/4885OPRK1 563/4885PDE10A 2863/4885

“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.