SCHEMBL4839335

SCHEMBL4839335

COc1ccc(C(=O)C2CCCC2)c(C(=O)O)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 3/20 0.50
CPS1 P31327 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.49
ALDH1A1 P00352 4/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
KDM4E B2RXH2 3/20 0.46
POLB P06746 2/20 0.46
HSD17B10 Q99714 1/20 0.46
AKR1C3 P42330 2/20 0.46
AKR1C2 P52895 2/20 0.46
RAB9A P51151 2/20 0.46
LMNA P02545 2/20 0.46
NPC1 O15118 1/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL7423445 0.94 KDM2B (0.50) KDM2BCPS1SMN1; SMN2ALDH1A1MEN1
SCHEMBL4841620 0.94 CPS1 (0.52) KDM2BCPS1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL4131191 0.87 ALDH1A1 (0.53) KDM2BCPS1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL1340897 0.82 NOS2 (0.48) KDM2BCPS1SMN1; SMN2ALDH1A1MEN1
SCHEMBL4115692 0.82 KDM2B (0.47) KDM2BCPS1SMN1; SMN2ALDH1A1MEN1
SCHEMBL14477305 0.82 KDM2B (0.50) KDM2BCPS1ALDH1A1MEN1KMT2A
SCHEMBL4113759 0.82 MAPT (0.61) KDM2BCPS1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL16163091 0.81 POLB (0.61) KDM2BCPS1ALDH1A1MEN1KMT2A
SCHEMBL5280460 0.81 KDM2B (0.49) KDM2BCPS1SMN1; SMN2ALDH1A1MEN1
SCHEMBL1942608 0.81 CPS1 (0.70) KDM2BCPS1MEN1KMT2A

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 KDM2B 2966/4885CPS1 180/4885SMN1; 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.