SCHEMBL8495301

SCHEMBL8495301

O=c1oc(-c2ccccc2F)nc2cc(F)c(F)cc12.O=c1oc(-c2ccco2)nc2cc(F)c(F)cc12.O=c1oc(-c2cccs2)nc2cc(F)c(F)cc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.50
▸ HPGD P15428 4/20 0.50
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ F2 P00734 3/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ HSD17B10 Q99714 2/20 0.49
▸ POLB P06746 2/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ KDM4E B2RXH2 6/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ APEX1 P27695 1/20 0.48
▸ ELANE P08246 2/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ C1R P00736 1/20 0.48
▸ ADORA2A P29274 1/20 0.47
▸ F10 P00742 2/20 0.44
▸ F7 P08709 2/20 0.44
▸ F3 P13726 2/20 0.44

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
SCHEMBL915806 0.83 HSD17B10 (0.67) ALDH1A1HPGDMEN1KMT2AF2
SCHEMBL915753 0.82 ALDH1A1 (0.65) ALDH1A1HPGDKMT2ASMN1; SMN2HSD17B10
SCHEMBL8496538 0.82 F7 (0.49) ALDH1A1HPGDMEN1KMT2AF2
SCHEMBL915773 0.80 C1R (0.73) MEN1KMT2AF2APEX1ELANE
SCHEMBL913737 0.70 C1R (0.57) MEN1KMT2AF2APEX1ELANE
SCHEMBL913374 0.69 ALDH1A1 (1.00) ALDH1A1HPGDMEN1KMT2AF2
SCHEMBL17554083 0.68 APEX1 (0.76) MEN1KMT2AF2APEX1ELANE
SCHEMBL5921477 0.67 ALDH1A1 (1.00) ALDH1A1HPGDMEN1KMT2AF2
SCHEMBL30884604 0.67 C1R (1.00) ALDH1A1HPGDMEN1KMT2AF2
SCHEMBL915734 0.67 C1R (1.00) ALDH1A1HPGDMEN1KMT2AF2

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
WO-1999048878-A1 HETEROCYCLIC COMPOUNDS REGULATING CLOTTING NOVO NORDISK A/S (DK) 1999-09-30 — — WO disclosed
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