SCHEMBL9213416

SCHEMBL9213416

Cc1cc2c(=O)c3ccccc3oc2nc1C

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 9/20 0.68
▸ MEN1 O00255 8/20 0.68
▸ RAB9A P51151 8/20 0.64
▸ NPC1 O15118 8/20 0.64
▸ KDM4E B2RXH2 5/20 0.55
▸ RECQL P46063 1/20 0.55
▸ ALDH1A1 P00352 6/20 0.52
▸ SMN1; SMN2 Q16637 5/20 0.52
▸ HPGD P15428 3/20 0.52
▸ HSD17B10 Q99714 3/20 0.52
▸ CYP3A4 P08684 2/20 0.52
▸ MAPT P10636 2/20 0.52
▸ GLA P06280 1/20 0.52
▸ PGAM1 P18669 1/20 0.52
▸ MAOA P21397 1/20 0.52
▸ CASP1 P29466 1/20 0.52
▸ CASP7 P55210 1/20 0.52
▸ PKM P14618 1/20 0.49
▸ LMNA P02545 1/20 0.47
▸ TTR P02766 1/20 0.46

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
SCHEMBL9206022 0.85 KMT2A (0.61) KMT2AMEN1RAB9ANPC1KDM4E
SCHEMBL17072179 0.81 KMT2A (0.81) KMT2AMEN1RAB9ANPC1KDM4E
SCHEMBL12983484 0.81 KMT2A (0.61) KMT2AMEN1RAB9ANPC1KDM4E
SCHEMBL19196681 0.79 TBK1 (0.64) KMT2AMEN1RAB9ANPC1KDM4E
SCHEMBL9214814 0.76 RAB9A (1.00) KMT2AMEN1RAB9ANPC1KDM4E
SCHEMBL16477274 0.75 MAOA (0.67) KMT2AMEN1RAB9ANPC1KDM4E
SCHEMBL20042639 0.73 KMT2A (0.47) KMT2AMEN1RAB9ANPC1KDM4E
SCHEMBL9214682 0.73 KMT2A (0.54) KMT2AMEN1RAB9ANPC1KDM4E
SCHEMBL22171892 0.72 KDM4E (0.60) KMT2AMEN1RAB9ANPC1KDM4E
Xanthone SCHEMBL41161 0.71 MAOA (1.00) KMT2AMEN1RAB9ANPC1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0561845-B1 PYRIDO-ANELLATED 4-OXO-4H-BENZOPYRANS, A METHOD OF PREPARING THEM, AND THEIR USE AS ANTIDOTES BASF AG (DE) 1995-03-08 — — EP claimed
EP-0561845-A1 PYRIDO-ANELLATED 4-OXO-4H-BENZOPYRANS, A METHOD OF PREPARING THEM, AND THEIR USE AS ANTIDOTES. BASF AG (DE) 1993-09-29 — — EP claimed
WO-1992010500-A1 PYRIDO-ANELLATED 4-OXO-4H-BENZOPYRANS, A METHOD OF PREPARING THEM, AND THEIR USE AS ANTIDOTES BASF AKTIENGESELLSCHAFT (DE) 1992-06-25 — — WO claimed
US-8034940-B2 Modulators of glucocorticoid receptor, AP-1, and/or NF-κB activity and use thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2011-10-11 — — US disclosed
US-20090075995-A1 MODULATORS OF GLUCOCORTICOID RECEPTOR, AP-1, AND/OR NF-kB ACTIVITY AND USE THEREOF BRISTOL-MYERS SQUIBB COMPANY 2009-03-19 — — US disclosed
EP-0561845-B1 PYRIDO-ANELLATED 4-OXO-4H-BENZOPYRANS, A METHOD OF PREPARING THEM, AND THEIR USE AS ANTIDOTES BASF AG (DE) 1995-03-08 — — EP 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-20090075995-A1 MODULATORS OF GLUCOCORTICOID RECEPTOR, AP-1, AND/OR NF-kB ACTIVITY AND USE THEREOF NFKB2, NFRKB, NFKB1 KMT2A 2166/4885MEN1 3158/4885RAB9A 1324/4885

“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.

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