SCHEMBL7170779

SCHEMBL7170779

COc1ccc(-n2cc(C(=O)O)c(=O)c3cccnc32)cc1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 9/20 0.60
KCNH2 Q12809 7/20 0.60
RORC P51449 1/20 0.48
CHRM1 P11229 1/20 0.48
TP53 P04637 1/20 0.46
MAPT P10636 1/20 0.46
LMNA P02545 1/20 0.46
PTPN11 Q06124 2/20 0.46
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
HPGD P15428 1/20 0.46
NPC1 O15118 1/20 0.45
HTT P42858 1/20 0.45
RAB9A P51151 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
KAT2B Q92831 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
SCHEMBL7171836 0.86 PDE4A (0.61) PDE4AKCNH2RORCKDM4EHPGD
SCHEMBL7173606 0.86 PDE4A (0.70) PDE4AKCNH2RORCKDM4E
SCHEMBL7195442 0.85 ALDH1A1 (0.58) PDE4AKCNH2TP53MAPTLMNA
SCHEMBL28517886 0.84 PDE4A (0.61) PDE4AKCNH2RORCLMNAKDM4E
SCHEMBL7169314 0.84 PDE4A (0.66) PDE4AKCNH2RORCMAPTKDM4E
SCHEMBL7171641 0.84 PDE4A (0.58) PDE4AKCNH2RORCLMNAALDH1A1
SCHEMBL7170883 0.84 KCNH2 (0.60) PDE4AKCNH2RORCKDM4E
SCHEMBL7176329 0.83 PDE4A (0.58) PDE4AKCNH2TP53MAPTLMNA
SCHEMBL7171943 0.80 KCNH2 (0.59) PDE4AKCNH2RORCKDM4E
SCHEMBL7169736 0.78 PDE4A (0.64) PDE4AKCNH2TP53LMNAALDH1A1

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
CN-112047941-B Compound and application thereof in preparing medicine for treating diseases caused by high expression of Flt3/c-Met kinase 温州医科大学 2021-10-29 CN disclosed
CN-112047941-A Compound and application thereof in preparing medicine for treating diseases caused by high expression of Flt3/c-Met kinase 温州医科大学 2020-12-08 CN disclosed
US-6541480-B2 Controlling cytokines SUNTORY LIMITED (JP) 2003-04-01 US disclosed
US-20020006935-A1 1-aryl-1,8-naphthylidin-4-one derivative as type IV phosphodiesterase inhibitor DAIICHI ASUBIO PHARMA CO., LTD. (JP) 2002-01-17 US disclosed
US-6297248-B1 1-aryl-1,8-naphthylidin-4-one derivative as type IV phosphodiesterase inhibitor SUNTORY LIMITED (JP) 2001-10-02 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-20020006935-A1 1-aryl-1,8-naphthylidin-4-one derivative as type IV phosphodiesterase inhibitor PDE3A, PDE5A, PDE3B PDE4A 4/4885KCNH2 559/4885RORC 2335/4885

“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.