SCHEMBL6771863

SCHEMBL6771863

Cc1cc(C(=O)C=Cc2ccc(F)c(Cl)c2)c(O)c([N+](=O)[O-])c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.47
▸ RAB9A P51151 3/20 0.47
▸ RECQL P46063 2/20 0.47
▸ MITF O75030 2/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ MAOB P27338 6/20 0.46
▸ MAOA P21397 6/20 0.46
▸ DBH P09172 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ GPR35 Q9HC97 1/20 0.43
▸ COMT P21964 2/20 0.42
▸ CXCL12 P48061 1/20 0.42
▸ NPC1 O15118 2/20 0.41
▸ ATM Q13315 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ HSP90AA1 P07900 1/20 0.41

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
SCHEMBL6771857 1.00 MAPT (0.47) MAPTRAB9ARECQLMITFNPSR1
SCHEMBL6767061 0.83 TUBB1 (0.56) MAPTRAB9ANPSR1MAOADBH
SCHEMBL6767057 0.83 TUBB1 (0.56) MAPTRAB9ANPSR1MAOADBH
SCHEMBL6770393 0.83 MAOB (0.60) MAPTMAOBMAOAALDH1A1GPR35
SCHEMBL6770402 0.83 MAOB (0.60) MAPTMAOBMAOAALDH1A1GPR35
SCHEMBL6776282 0.80 BACE1 (0.47) MAPTRAB9ARECQLMITFNPSR1
SCHEMBL6776289 0.80 BACE1 (0.47) MAPTRAB9ARECQLMITFNPSR1
SCHEMBL7659900 0.76 MAOB (0.56) MAPTRAB9ANPSR1MAOBMAOA
SCHEMBL6770296 0.74 APP (0.61) MAPTRAB9AMAOBNPC1
SCHEMBL6770302 0.74 APP (0.61) MAPTRAB9AMAOBNPC1

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-6683095-B2 ANTICARCINOGENIC AGENTS; ANTIPROLIFERATION AGENTS LG LIFE SCIENCES LTD. (KR) 2004-01-27 — — US disclosed
US-20030125356-A1 Cdk inhibitors having 3-hydroxychromen-4-one structure LG LIFE SCIENCES LTD. (KR) 2003-07-03 — — 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-20030125356-A1 Cdk inhibitors having 3-hydroxychromen-4-one structure CDK4, CDK3, CDK6 MAPT 2270/4885RAB9A 4302/4885RECQL 1285/4885

“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.

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