SCHEMBL4838604

SCHEMBL4838604

COc1ccc(C(=O)Cc2ccccc2)c(C(=O)O)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.73
TP53 P04637 2/20 0.73
SMN1; SMN2 Q16637 7/20 0.55
RAB9A P51151 6/20 0.55
NPC1 O15118 5/20 0.55
ALDH1A1 P00352 3/20 0.54
MEN1 O00255 2/20 0.54
HPGD P15428 2/20 0.54
KMT2A Q03164 2/20 0.54
CYP3A4 P08684 1/20 0.54
ATM Q13315 1/20 0.54
LMNA P02545 2/20 0.52
HTT P42858 1/20 0.52
AKR1C3 P42330 3/20 0.51
AKR1C2 P52895 3/20 0.51
TSHR P16473 2/20 0.50
KDM4E B2RXH2 2/20 0.49
MAPT P10636 2/20 0.49
ALOX12 P18054 1/20 0.49
HSD17B10 Q99714 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
SCHEMBL28589540 0.94 USP2 (0.73) USP2TP53SMN1; SMN2RAB9ANPC1
SCHEMBL29586539 0.85 NPC1 (0.74) USP2TP53SMN1; SMN2RAB9ANPC1
SCHEMBL150915 0.85 NPC1 (0.68) USP2TP53SMN1; SMN2RAB9ANPC1
SCHEMBL17637149 0.85 HSD11B1 (0.63) USP2TP53SMN1; SMN2RAB9ANPC1
SCHEMBL3811897 0.85 NPC1 (0.74) USP2TP53SMN1; SMN2RAB9ANPC1
SCHEMBL29586454 0.85 NPC1 (0.68) USP2TP53SMN1; SMN2RAB9ANPC1
SCHEMBL28569171 0.84 USP2 (0.58) USP2TP53SMN1; SMN2RAB9ANPC1
SCHEMBL4841164 0.83 TP53 (0.51) USP2TP53SMN1; SMN2RAB9ANPC1
Benzene SCHEMBL29227606 0.82 ALDH1A1 (0.63) USP2TP53SMN1; SMN2RAB9ANPC1
SCHEMBL7500592 0.81 USP2 (0.59) USP2TP53SMN1; SMN2RAB9ANPC1

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 2 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
US-20070099895-A1 1-AMINO-PHTHALAZINE DERIVATIVES, THE PREPARATION AND THE THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-05-03 US 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 USP2 3551/4885TP53 1301/4885SMN1; SMN2 1239/4885

“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.