SCHEMBL905602

SCHEMBL905602

O=c1[nH]nc(Cc2ccncc2)c2ncccc12

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 14/20 0.76
AR P10275 1/20 0.54
LMNA P02545 1/20 0.49
TSHR P16473 1/20 0.49
FLT1 P17948 2/20 0.45
KDR P35968 2/20 0.45
ENPP1 P22413 1/20 0.42

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
SCHEMBL905666 0.89 PARP1 (0.60) PARP1ARLMNATSHRFLT1
SCHEMBL4439381 0.86 PARP1 (1.00) PARP1ARLMNATSHRENPP1
SCHEMBL905630 0.82 AR (0.79) PARP1ARLMNATSHRENPP1
SCHEMBL15908005 0.80 PARP1 (0.69) PARP1ARTSHR
SCHEMBL14051406 0.80 PARP1 (0.69) PARP1ARTSHR
SCHEMBL24835102 0.79 PARP1 (0.62) PARP1ARLMNATSHR
SCHEMBL30169667 0.79 PARP1 (0.62) PARP1ARLMNATSHR
SCHEMBL15633340 0.79 PARP1 (0.62) PARP1ARLMNATSHR
SCHEMBL4434847 0.77 PARP1 (1.00) PARP1LMNAENPP1
SCHEMBL4433410 0.77 PARP1 (1.00) PARP1LMNAENPP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2277595-A2 Compounds for immunopotentiation Novartis Vaccines and Diagnostics, Inc. (US) 2011-01-26 EP disclosed
US-20100226931-A1 Compounds for immunopotentiation NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2010-09-09 US disclosed
EP-1765313-A2 COMPOUNDS FOR IMMUNOPOTENTIATION Novartis Vaccines and Diagnostics, Inc. (US) 2007-03-28 EP disclosed
WO-2006002422-A9 COMPOUNDS FOR IMMUNOPOTENTIATION CHIRON CORP (US) 2006-09-21 WO disclosed
WO-2006002422-A2 COMPOUNDS FOR IMMUNOPOTENTIATION NOVARTIS VACCINES AND DIAGNOSTICS INC. (US) 2006-01-05 WO disclosed
EP-1562602-A2 IMMEDIATE RELEASE TOPICAL PHARMACEUTICAL FORMULATION FOR ENHANCEMENT OF FEMALE SEXUAL DESIRE AND RESPONSIVENESS Vivus, Inc. (US) 2005-08-17 EP disclosed
EP-0970070-B1 PHTHALAZINES WITH ANGIOGENESIS INHIBITING ACTIVITY NOVARTIS AG (CH) 2004-10-06 EP disclosed
WO-2004037262-A2 IMMEDIATE RELEASE TOPICAL PHARMACEUTICAL FORMULATION FOR ENHANCEMENT OF FEMALE SEXUAL DESIRE AND RESPONSIVENESS VIVUS, INC. (US) 2004-05-06 WO disclosed
US-6710047-B2 INHIBIT THE ACTIVITY OF THE VEGF RECEPTOR TYROSINE KINASE AND THE GROWTH OF TUMOURS NOVARTIS AG (CH) 2004-03-23 US disclosed
US-20030191129-A1 Phthalazines with angiogenesis inhibiting activity BOLD GUIDO (CH) 2003-10-09 US disclosed
US-6514974-B2 1-(4-Chloroanilino)-4-(4-pyridylmethyl)phthalazine for example NOVARTIS AG (CH) 2003-02-04 US disclosed
US-20020091261-A1 Phthalazines with angiogenesis inhibiting activity BOLD GUIDO (CH) 2002-07-11 US disclosed
US-6258812-B1 ANGIOGENESIS INHIBITORS, ANTITUMOR AGENTS AND CARDIOVASCULAR DISORDERS NOVARTIS AG (CH) 2001-07-10 US disclosed
EP-0970070-A1 PHTHALAZINES WITH ANGIOGENESIS INHIBITING ACTIVITY Novartis AG (CH) 2000-01-12 EP disclosed
WO-1998035958-A1 PHTHALAZINES WITH ANGIOGENESIS INHIBITING ACTIVITY NOVARTIS AG (CH) 1998-08-20 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 (3 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-20030191129-A1 Phthalazines with angiogenesis inhibiting activity PGF, VEGFA, FLT4 PARP1 3676/4885AR 908/4885LMNA 3374/4885
US-20100226931-A1 Compounds for immunopotentiation LY96, ICOS, PDCD1 PARP1 2421/4885AR 4565/4885LMNA 4838/4885
US-20020091261-A1 Phthalazines with angiogenesis inhibiting activity PGF, VEGFA, FLT4 PARP1 3475/4885AR 807/4885LMNA 3060/4885

“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.