SCHEMBL8787263

SCHEMBL8787263

S=c1cc(-c2ncc[nH]2)oc2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRA2A P08913 3/20 0.64
▸ MAOB P27338 5/20 0.52
▸ ADRA2B P18089 2/20 0.49
▸ ADRA2C P18825 2/20 0.49
▸ MEN1 O00255 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ MTOR P42345 1/20 0.41
▸ ADK P55263 1/20 0.41
▸ NISCH Q9Y2I1 1/20 0.41
▸ CYP1B1 Q16678 4/20 0.38
▸ CYP1A1 P04798 3/20 0.38
▸ CYP1A2 P05177 3/20 0.38
▸ GRM4 Q14833 3/20 0.38
▸ F2RL1 P55085 1/20 0.38
▸ PLA2G2A P14555 1/20 0.36
▸ PLA2G4A P47712 1/20 0.36
▸ GABRP O00591 1/20 0.36
▸ GABRD O14764 1/20 0.36
▸ NPC1 O15118 1/20 0.36

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
SCHEMBL563350 0.78 ADRA2A (1.00) ADRA2AMAOBADRA2BADRA2CMEN1
Hydrochloric Acid SCHEMBL30865655 0.77 ADRA2A (0.97) ADRA2AMAOBADRA2BADRA2CMEN1
Hydrochloric Acid SCHEMBL9295322 0.77 ADRA2A (0.97) ADRA2AMAOBADRA2BADRA2CMEN1
SCHEMBL8787416 0.74 ALDH1A1 (0.49) MAOBMEN1ALDH1A1KMT2ANPC1
SCHEMBL26661230 0.74 MAOB (0.75) MAOBCYP1B1CYP1A1CYP1A2PLA2G2A
SCHEMBL8787065 0.74 MAOB (0.53) MAOBMEN1ALDH1A1KMT2ACYP1B1
SCHEMBL8787194 0.72 MAOB (0.50) MAOBCYP1B1CYP1A1CYP1A2GRM4
SCHEMBL8787940 0.71 MAOB (0.49) MAOBCYP1B1CYP1A1CYP1A2GRM4
SCHEMBL3702761 0.70 ADRA2A (0.48) ADRA2AADRA2BADRA2CMEN1ALDH1A1
SCHEMBL7310923 0.70 ADRA2A (0.48) ADRA2AADRA2BADRA2CMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5698575-A Chromone compounds, pharmaceutical compositions containing the same, and use of the same KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) 1997-12-16 — — US disclosed
EP-0758649-A1 Chromone derivative, process for preparing same and pharmaceutical composition Kureha Chemical Industry Co., Ltd. (JP) 1997-02-19 — — EP disclosed
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