SCHEMBL538144

SCHEMBL538144

Fc1c(Cl)nc2cccc(F)c2c1F

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.43
PARP1 P09874 3/20 0.42
ACHE P22303 3/20 0.39
ELANE P08246 1/20 0.39
PABPC1 P11940 1/20 0.35
PKM P14618 2/20 0.34
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
HSP90AB1 P08238 1/20 0.33
TNKS O95271 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33

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
SCHEMBL29077016 0.76 PARP1 (0.50) PARP1ACHEKDM4EHSP90AB1
SCHEMBL10581936 0.76 ACHE (0.46) PARP1ACHEKDM4EHSP90AB1
SCHEMBL29909242 0.76 PARP1 (0.42) TDP1PARP1ACHEELANENPC1
SCHEMBL1995692 0.76 PARP1 (0.42) TDP1PARP1ACHEELANENPC1
SCHEMBL537851 0.76 PARP1 (0.46) PARP1ACHEELANEHSP90AB1
SCHEMBL2126781 0.76 PARP1 (0.46) TDP1PARP1ACHEELANEHSP90AB1
SCHEMBL2930063 0.74 PARP1 (0.41) TDP1PARP1ACHEELANENPC1
SCHEMBL14842829 0.73 PARP1 (0.47) TDP1PARP1ACHEELANEKDM4E
SCHEMBL2608529 0.73 PARP1 (0.44) TDP1PARP1ACHEELANEPABPC1
SCHEMBL23015239 0.72 PARP1 (0.42) PARP1ACHEELANEPKMNPC1

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-8598159-B2 Therapeutic pyrazoloquinoline derivatives DART NEUROSCIENCE (CAYMAN) LTD. (KY) 2013-12-03 US disclosed
EP-2166852-B1 THERAPEUTIC PYRAZOLOQUINOLINE DERIVATIVES HELICON THERAPEUTICS INC (US) 2012-02-08 EP disclosed
US-20110065693-A1 THERAPEUTIC PYRAZOLOQUINOLINE DERIVATIVES HELICON THERAPEUTICS, INC. (US) 2011-03-17 US disclosed
US-7872002-B2 Therapeutic pyrazoloquinoline derivatives HELICON THERAPEUTICS, INC. (US) 2011-01-18 US disclosed
EP-2166852-A1 THERAPEUTIC PYRAZOLOQUINOLINE DERIVATIVES Helicon Therapeutics, Inc. (US) 2010-03-31 EP disclosed
WO-2008154438-A1 THERAPEUTIC PYRAZOLOQUINOLINE DERIVATIVES HELICON THERAPEUTICS, INC. (US) 2008-12-18 WO disclosed
US-20080306049-A1 THERAPEUTIC PYRAZOLOQUINOLINE DERIVATIVES HELICON THERAPEUTICS, INC. (US) 2008-12-11 US disclosed
WO-1997048705-A1 POTASSIUM CHANNEL BLOCKERS UNIVERSITY COLLEGE LONDON (GB) 1997-12-24 WO disclosed
EP-0379414-A1 1,8-Benzonaphthyridine derivatives and their preparation Société anonyme dite: LABORATOIRE ROGER BELLON (FR) 1990-07-25 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 (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-20080306049-A1 THERAPEUTIC PYRAZOLOQUINOLINE DERIVATIVES GABRA5, GABRB1, GABRB2 TDP1 2226/4885PARP1 4637/4885ACHE 3162/4885
US-20110065693-A1 THERAPEUTIC PYRAZOLOQUINOLINE DERIVATIVES GABRA5, GABRB1, GABRB2 TDP1 2226/4885PARP1 4637/4885ACHE 3162/4885

“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.