SCHEMBL10904835

SCHEMBL10904835

Cc1nc2ccccc2nc1Oc1ccc(O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ LTA4H P09960 2/20 0.47
▸ NR1H2 P55055 1/20 0.47
▸ BAX Q07812 1/20 0.47
▸ TSHR P16473 1/20 0.46
▸ CYP1A2 P05177 2/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ LMNA P02545 3/20 0.44
▸ HTT P42858 3/20 0.44
▸ HRH4 Q9H3N8 1/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ ESR1 P03372 1/20 0.43
▸ ESR2 Q92731 1/20 0.43
▸ KDM4E B2RXH2 6/20 0.43
▸ HPGD P15428 5/20 0.43
▸ ALDH1A1 P00352 5/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ MAPT P10636 1/20 0.42

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
SCHEMBL10906895 0.80 L3MBTL1 (0.72) L3MBTL1TSHRCYP1A2CYP2C19LMNA
SCHEMBL10706728 0.79 LTA4H (0.47) L3MBTL1LTA4HNR1H2BAXCYP1A2
SCHEMBL11110766 0.73 MAPK1 (0.54) LTA4HNR1H2BAXTSHRCYP2C9
SCHEMBL24287258 0.73 ALDH1A1 (0.50) L3MBTL1TSHRCYP1A2CYP2C9CYP2C19
SCHEMBL9275102 0.72 LMNA (0.50) LTA4HNR1H2BAXTSHRCYP1A2
SCHEMBL18292683 0.72 HRH4 (0.46) L3MBTL1TSHRCYP1A2CYP2C9CYP2C19
SCHEMBL18796308 0.72 EGFR (0.47) L3MBTL1TSHRCYP1A2CYP2C9CYP2C19
SCHEMBL804981 0.71 TSHR (0.61) L3MBTL1TSHRCYP1A2LMNAHRH4
SCHEMBL20540182 0.71 HTT (0.57) L3MBTL1LTA4HTSHRCYP1A2CYP2C9
SCHEMBL16795314 0.70 ALDH1A1 (0.54) L3MBTL1TSHRCYP1A2LMNAHTT

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-4609396-A GRASSES IN BROADLEAF CROPS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1986-09-02 — — US disclosed
EP-0042750-A2 Quinoxalinyloxy ethers as selective weed control agents E.I. DU PONT DE NEMOURS AND COMPANY (US) 1981-12-30 — — EP disclosed
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