SCHEMBL7082437

SCHEMBL7082437

Nc1cnc2c(F)c(F)ccc2c1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 1/20 0.37
CCR1 P32246 2/20 0.36
CCR5 P51681 2/20 0.36
CCR8 P51685 2/20 0.36
PARP1 P09874 1/20 0.33
MAPT P10636 2/20 0.32
EGFR P00533 2/20 0.32
MAP4K4 O95819 1/20 0.31
SYK P43405 3/20 0.31
TET2 Q6N021 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
BCL6 P41182 1/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 1/20 0.31
PLAU P00749 1/20 0.31
CYP3A4 P08684 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL29698775 0.81 CCR1 (0.34) CCR1CCR5CCR8PARP1MAPT
SCHEMBL1073946 0.81 CCR1 (0.52) CCR1CCR5CCR8PARP1MAPT
SCHEMBL31058344 0.81 CCR1 (0.52) CCR1CCR5CCR8PARP1MAPT
SCHEMBL4157022 0.77 SMN1; SMN2 (0.42) ABCG2PARP1MAPTSYKMEN1
SCHEMBL29801578 0.77 TET2 (0.44) ABCG2CCR1CCR5CCR8TET2
SCHEMBL12483271 0.77 ABCG2 (0.40) ABCG2CCR1CCR5CCR8MAP4K4
SCHEMBL25519639 0.77 CCR1 (0.67) ABCG2CCR1CCR5CCR8PARP1
SCHEMBL12483903 0.77 TET2 (0.44) ABCG2CCR1CCR5CCR8TET2
SCHEMBL28088161 0.77 ABCG2 (0.37) ABCG2CCR1CCR5CCR8
SCHEMBL28012715 0.77 ABCG2 (0.37) ABCG2CCR1CCR5CCR8TET2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210387964-A1 HETEROARYLAMINOQUINOLINES AND ANALOGUES BAYER AKTIENGESELLSCHAFT (DE) 2021-12-16 US disclosed
CN-112888682-A Heteroaryl aminoquinolines and analogs 拜耳公司 2021-06-01 CN disclosed
WO-2020079167-A1 HETEROARYLAMINOQUINOLINES AND ANALOGUES BAYER AKTIENGESELLSCHAFT (DE) 2020-04-23 WO disclosed
CN-105906563-B The synthetic method of 7,8- difluoro-quinoline -3- formic acid 苏州康润医药有限公司 2019-01-22 CN disclosed
CN-105906563-A Synthesis method of 7, 8-difluoroquinoline-3-formic acid 苏州康润医药有限公司 2016-08-31 CN disclosed
CN-105906563-A Synthesis method of 7, 8-difluoroquinoline-3-formic acid 苏州康润医药有限公司 2016-08-31 CN disclosed
CN-104447543-B Synthesis method of 3-amino-7, 8-difluoroquinoline and intermediate thereof 苏州康润医药有限公司 2016-08-24 CN disclosed
CN-104447543-B Synthesis method of 3-amino-7, 8-difluoroquinoline and intermediate thereof 苏州康润医药有限公司 2016-08-24 CN disclosed
CN-104447543-A Synthesis method of 3-amino-7, 8-difluoroquinoline and intermediate thereof SUZHOU KANGRUN PHARMACEUTICALS INC 2015-03-25 CN disclosed
CN-104447543-A Synthesis method of 3-amino-7, 8-difluoroquinoline and intermediate thereof SUZHOU KANGRUN PHARMACEUTICALS INC 2015-03-25 CN disclosed
CN-104447543-A Synthesis method of 3-amino-7, 8-difluoroquinoline and intermediate thereof SUZHOU KANGRUN PHARMACEUTICALS INC 2015-03-25 CN disclosed
EP-1189903-B1 NOVEL BENZO[F]NAPHTHYRIDINE, PREPARATION AND COMPOSITIONS CONTAINING THEM AVENTIS PHARMA SA (FR) 2003-05-28 EP disclosed
US-6566362-B2 Use as topical antibiotics AVENTIS PHARMA S.A. (FR) 2003-05-20 US disclosed
US-20020137741-A1 Benzo[f]naphthyridine derivatives, their preparation and compositions containing them AVENTIS PHARMA S.A. (FR) 2002-09-26 US disclosed
EP-1189903-A1 NOVEL BENZO F]NAPHTHYRIDINE, PREPARATION AND COMPOSITIONS CONTAINING THEM Aventis Pharma S.A. (FR) 2002-03-27 EP disclosed
WO-2001002396-A1 NOVEL BENZO[F]NAPHTHYRIDINE, PREPARATION AND COMPOSITIONS CONTAINING THEM AVENTIS PHARMA S.A. (FR) 2001-01-11 WO 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 (2 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-20020137741-A1 Benzo[f]naphthyridine derivatives, their preparation and compositions containing them KCNQ2, KCNQ1, KCNQ4 ABCG2 148/4885CCR1 4877/4885CCR5 4740/4885
US-20210387964-A1 HETEROARYLAMINOQUINOLINES AND ANALOGUES PIK3C3, ERG28, CBR3 ABCG2 258/4885CCR1 4678/4885CCR5 4586/4885

“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.