SCHEMBL8063262

SCHEMBL8063262

CCCCCOc1cc(C=CC(=O)c2ccccc2)c(O)cc1OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 3/20 0.52
▸ TYR P14679 1/20 0.48
▸ DPP4 P27487 1/20 0.48
▸ LMNA P02545 3/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ PLA2G2D Q9UNK4 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ BLM P54132 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ PTGER1 P34995 1/20 0.46
▸ PTGER4 P35408 1/20 0.46
▸ PTGER3 P43115 1/20 0.46
▸ PTGER2 P43116 1/20 0.46
▸ NPC1 O15118 1/20 0.45
▸ BCHE P06276 1/20 0.45
▸ MAPT P10636 1/20 0.45

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
SCHEMBL8064357 0.89 PTPN1 (0.54) PTPN1DPP4NPC1RAB9AABCG2
SCHEMBL28081840 0.80 MAPT (0.69) LMNAALDH1A1NPC1BCHEMAPT
SCHEMBL1577012 0.80 TYR (0.59) PTPN1TYRDPP4BCHEABCG2
SCHEMBL1577013 0.80 TYR (0.59) PTPN1TYRDPP4BCHEABCG2
SCHEMBL8062149 0.80 PTPN1 (0.61) PTPN1PTGER4PTGER2NPC1RAB9A
SCHEMBL28535054 0.79 MAPT (0.68) LMNAALDH1A1MEN1KMT2ANPC1
SCHEMBL27456464 0.79 MAPT (0.68) LMNAALDH1A1MEN1KMT2ANPC1
SCHEMBL10497646 0.79 MAPT (0.68) LMNAALDH1A1MEN1KMT2ANPC1
SCHEMBL10497662 0.79 MAPT (0.68) LMNAALDH1A1MEN1KMT2ANPC1
SCHEMBL27746894 0.78 PTGER1 (0.72) PTPN1LMNAALDH1A1THRBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6025387-A Gastroprotective flavone/flavanone compounds with therapeutic effect on inflammatory bowel disease DONG A PHARMACEUTICAL CO., LTD. (KR) 2000-02-15 — — US disclosed
EP-0915864-A1 GASTROPROTECTIVE FLAVONE/FLAVANONE COMPOUNDS WITH THERAPEUTIC EFFECT ON INFLAMMATORY BOWEL DISEASE Dong A Pharmaceutical Co. Ltd. (KR) 1999-05-19 — — EP disclosed
WO-1998004541-A1 GASTROPROTECTIVE FLAVONE/FLAVANONE COMPOUNDS WITH THERAPEUTIC EFFECT ON INFLAMMATORY BOWEL DISEASE DONG A PHARMACEUTICAL CO., LTD. (KR) 1998-02-05 — — WO disclosed
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