SCHEMBL4834657

SCHEMBL4834657

O=c1[nH]nc(-c2ccc(F)cc2)c2ccc(F)cc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
MAP2K4 P45985 6/20 0.50
ALDH1A1 P00352 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
MAPK1 P28482 1/20 0.50
MAPK6 Q16659 1/20 0.50
MAP2K7 O14733 1/20 0.49
MAPT P10636 3/20 0.46
ROCK1 Q13464 2/20 0.46
ROCK2 O75116 2/20 0.46
KDM4E B2RXH2 1/20 0.46
POLB P06746 1/20 0.46
GAA P10253 1/20 0.46
ALOX15 P16050 1/20 0.46
HSD17B10 Q99714 1/20 0.46
NAMPT P43490 1/20 0.46
ALPL P05186 1/20 0.44
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL7884963 0.84 ATM (0.73) ATMNPSR1ALDH1A1SMN1; SMN2MAPK1
SCHEMBL4840184 0.84 ENPP1 (0.61) MAP2K4ALDH1A1MAPK1ROCK1ROCK2
SCHEMBL1785622 0.83 NPSR1 (0.67) ATMNPSR1MAP2K4ALDH1A1SMN1; SMN2
SCHEMBL30319406 0.77 DAO (0.42) MAP2K4ALDH1A1MAPTKDM4EPOLB
SCHEMBL30984913 0.77 DAO (0.44) ATMNPSR1MAP2K4ALDH1A1MAPT
SCHEMBL29875213 0.74 TSHR (0.39) MAP2K4SMN1; SMN2MAPK1MAPK6KDM4E
SCHEMBL31690155 0.74 CASP3 (0.43) ALDH1A1MAPTPOLBLMNAPRMT5
SCHEMBL29875057 0.73 POLB (0.44) ALDH1A1MAPTPOLBLMNATSHR
SCHEMBL11165259 0.73 MAP2K4 (0.44) MAP2K4SMN1; SMN2MAPK1MAPK6KDM4E
SCHEMBL9226004 0.73 ATM (0.49) ATMNPSR1ALDH1A1SMN1; SMN2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7423030-B2 1-amino-phthalazine derivatives, the preparation and the therapeutic use thereof SANOFI-AVENTIS (FR) 2008-09-09 US disclosed
EP-1737840-B1 1-AMINO-PHTHALAZINE DERIVATIVES, THE PREPARATION AND THE THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2007-09-12 EP disclosed
US-20070099895-A1 1-AMINO-PHTHALAZINE DERIVATIVES, THE PREPARATION AND THE THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-05-03 US disclosed
EP-1737840-A1 1-AMINO-PHTHALAZINE DERIVATIVES, THE PREPARATION AND THE THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2007-01-03 EP disclosed
WO-2005103033-A1 1-AMINO-PHTHALAZINE DERIVATIVES, THE PREPARATION AND THE THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2005-11-03 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 (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-20070099895-A1 1-AMINO-PHTHALAZINE DERIVATIVES, THE PREPARATION AND THE THERAPEUTIC USE THEREOF CYP11B2, CYP11B1, GOT2 ATM 3654/4885NPSR1 255/4885MAP2K4 4806/4885

“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.