SCHEMBL2976084

SCHEMBL2976084

O=C(O)c1c[nH]c2c(F)cccc2c1=O

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CSNK2A2 P19784 3/20 0.63
▸ CSNK2B P67870 3/20 0.63
▸ CSNK2A1 P68400 3/20 0.63
▸ KDM4E B2RXH2 1/20 0.62
▸ ALDH1A1 P00352 1/20 0.62
▸ HPGD P15428 1/20 0.62
▸ DNA2 P51530 1/20 0.61
▸ CASP6 P55212 1/20 0.61
▸ CTDSP1 Q9GZU7 1/20 0.61
▸ RAB9A P51151 1/20 0.61
▸ GUSB P08236 13/20 0.56
▸ CYP1A2 P05177 1/20 0.55
▸ HSD17B10 Q99714 1/20 0.55

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
Hydrochloric Acid SCHEMBL31157465 0.98 CSNK2A2 (0.61) CSNK2A2CSNK2BCSNK2A1KDM4EALDH1A1
SCHEMBL2035484 0.90 GPR84 (0.53) CSNK2A2CSNK2BCSNK2A1KDM4EALDH1A1
SCHEMBL18589537 0.85 CSNK2A2 (0.69) CSNK2A2CSNK2BCSNK2A1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL6206962 0.84 GUSB (0.59) RAB9AGUSB
SCHEMBL1244916 0.82 CSNK2A2 (0.65) CSNK2A2CSNK2BCSNK2A1KDM4EALDH1A1
SCHEMBL9506409 0.81 RAB9A (0.55) KDM4ERAB9AGUSB
SCHEMBL4339753 0.81 CSNK2A2 (0.63) CSNK2A2CSNK2BCSNK2A1KDM4EALDH1A1
SCHEMBL7081618 0.81 CSNK2A2 (0.60) CSNK2A2CSNK2BCSNK2A1KDM4EALDH1A1
SCHEMBL2979929 0.81 CSNK2A2 (0.69) CSNK2A2CSNK2BCSNK2A1KDM4EALDH1A1
SCHEMBL2977498 0.81 KDM4E (0.67) CSNK2A2CSNK2BCSNK2A1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140343098-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-11-20 — — US disclosed
US-8802700-B2 Modulators of ATP-Binding Cassette transporters VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-08-12 — — US disclosed
US-8614327-B2 Modulators of ATP-binding cassette transporters VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-12-24 — — US disclosed
US-20130165442-A1 Modulators of ATP-Binding Cassette Transporters VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-06-27 — — US disclosed
US-8354427-B2 Modulators of ATP-binding cassette transporters VERTEX PHARMACEUTICAL INCORPORATED (US) 2013-01-15 — — US disclosed
US-20120309758-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-12-06 — — US disclosed
US-20100184739-A1 Modulators of ATP-Binding Cassette Transporters VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-07-22 — — US disclosed
CN-1044118-C 7-isoindolinyl-quinolone derivatives and process for their preparation BAYER AG (DE) 1999-07-14 — — CN disclosed
CN-1189494-A Substituted isoazalene compound BAYER AG (DE) 1998-08-05 — — CN 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 (4 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-20130165442-A1 Modulators of ATP-Binding Cassette Transporters CFTR, ABCB1, ABCC2 CSNK2A2 4063/4885CSNK2B 3358/4885CSNK2A1 4180/4885
US-20100184739-A1 Modulators of ATP-Binding Cassette Transporters CFTR, ABCB1, ABCC2 CSNK2A2 4063/4885CSNK2B 3358/4885CSNK2A1 4180/4885
US-20140343098-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS CFTR, ABCB1, ABCC2 CSNK2A2 4063/4885CSNK2B 3358/4885CSNK2A1 4180/4885
US-20120309758-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS CFTR, ABCB1, ABCC2 CSNK2A2 4063/4885CSNK2B 3358/4885CSNK2A1 4180/4885

“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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