SCHEMBL4128750

SCHEMBL4128750

COc1ccc(C(C)=O)c(C(=O)O)c1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.65
CYP3A4 P08684 1/20 0.65
HPGD P15428 1/20 0.65
MAPK1 P28482 1/20 0.65
SMN1; SMN2 Q16637 1/20 0.59
AKR1C3 P42330 11/20 0.55
AKR1C2 P52895 11/20 0.55
KDM4E B2RXH2 2/20 0.54
POLB P06746 2/20 0.54
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
MEN1 O00255 1/20 0.49
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL3037245 0.92 ALDH1A1 (0.65) ALDH1A1CYP3A4HPGDMAPK1SMN1; SMN2
SCHEMBL383820 0.90 ALDH1A1 (0.66) ALDH1A1CYP3A4HPGDMAPK1SMN1; SMN2
SCHEMBL13094612 0.90 ALDH1A1 (0.71) ALDH1A1CYP3A4HPGDMAPK1SMN1; SMN2
Benzene SCHEMBL29227606 0.88 ALDH1A1 (0.63) ALDH1A1CYP3A4HPGDMAPK1SMN1; SMN2
SCHEMBL5307872 0.86 NPC1 (0.63) ALDH1A1CYP3A4HPGDMAPK1SMN1; SMN2
SCHEMBL11940937 0.86 ALDH1A1 (0.61) ALDH1A1CYP3A4HPGDMAPK1SMN1; SMN2
SCHEMBL5736385 0.83 KDM4E (0.60) ALDH1A1SMN1; SMN2AKR1C3AKR1C2KDM4E
SCHEMBL14608284 0.83 SMN1; SMN2 (0.57) ALDH1A1CYP3A4HPGDMAPK1SMN1; SMN2
SCHEMBL3277227 0.83 ALDH1A1 (0.62) ALDH1A1CYP3A4HPGDMAPK1SMN1; SMN2
SCHEMBL2310701 0.83 ALDH1A1 (0.62) ALDH1A1CYP3A4HPGDMAPK1AKR1C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118063449-A Method for synthesizing isoindolinone from olefin and iodophor 南方医科大学 2024-05-24 CN disclosed
US-20090124624-A1 SUBSTITUTED 1-AMINOPHTHALAZINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2009-05-14 US disclosed
US-20090124624-A1 SUBSTITUTED 1-AMINOPHTHALAZINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2009-05-14 US disclosed
US-20090124624-A1 SUBSTITUTED 1-AMINOPHTHALAZINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2009-05-14 US disclosed
US-7423030-B2 1-amino-phthalazine derivatives, the preparation and the therapeutic use thereof SANOFI-AVENTIS (FR) 2008-09-09 US disclosed
US-20070099895-A1 1-AMINO-PHTHALAZINE DERIVATIVES, THE PREPARATION AND THE THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-05-03 US disclosed
CN-1953972-A 1-amino-phthalazine derivatives, their preparation and their therapeutic use SANOFI AVENTIS (FR) 2007-04-25 CN disclosed
WO-2007042660-A2 SUBSTITUTED 1-AMINO-PHTHALZINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-04-19 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-20070099895-A1 1-AMINO-PHTHALAZINE DERIVATIVES, THE PREPARATION AND THE THERAPEUTIC USE THEREOF CYP11B2, CYP11B1, GOT2 ALDH1A1 86/4885CYP3A4 562/4885HPGD 163/4885
US-20090124624-A1 SUBSTITUTED 1-AMINOPHTHALAZINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF AGTR1, AGTR2, AHR ALDH1A1 60/4885CYP3A4 338/4885HPGD 2634/4885

“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.