SCHEMBL5316206

SCHEMBL5316206

NNc1ccc2c(=O)n(Cc3ccc(Cl)c(Cl)c3)ccc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SCD O00767 5/20 0.46
▸ TDP1 Q9NUW8 2/20 0.42
▸ ALDH1A1 P00352 4/20 0.40
▸ MAPT P10636 3/20 0.40
▸ KDM4E B2RXH2 3/20 0.40
▸ GAA P10253 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ S1PR2 O95136 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ CYP3A4 P08684 3/20 0.40
▸ CYP2D6 P10635 3/20 0.40
▸ CYP2C9 P11712 3/20 0.40
▸ CYP2C19 P33261 3/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ CYP1A2 P05177 2/20 0.40
▸ POLB P06746 2/20 0.40
▸ HTT P42858 2/20 0.40
▸ MAPK1 P28482 1/20 0.40

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
SCHEMBL5310870 0.85 MAPT (0.47) ALDH1A1MAPTKDM4EGAASMN1; SMN2
SCHEMBL5311595 0.85 ACHE (0.44) MAPTSMN1; SMN2POLBLMNA
SCHEMBL5316623 0.83 CYP19A1 (0.42) TDP1ALDH1A1GAAL3MBTL1MEN1
SCHEMBL5309410 0.82 ALDH1A1 (0.43) ALDH1A1KDM4ESMN1; SMN2HPGDHTT
SCHEMBL5313061 0.82 MAPT (0.49) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL5311602 0.78 JAK3 (0.37) MAPTLMNA
SCHEMBL5311119 0.76 FLT3 (0.45) TDP1ALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL14015403 0.76 CCR2 (0.47) TDP1ALDH1A1MAPTKDM4EGAA
SCHEMBL5313087 0.74 GRM2 (0.52) POLB
SCHEMBL5313944 0.73 THRB (0.44) ALDH1A1MAPTKDM4EHPGDMEN1

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
WO-2007053352-A2 PYRROLOQUINOLINONE DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH (US) 2007-05-10 — — WO disclosed
US-20070099911-A1 Pyrroloquinolinone derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 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-20070099911-A1 Pyrroloquinolinone derivatives as 5-hydroxytryptamine-6 ligands HTR6, HTR5A, HTR2C SCD 3204/4885TDP1 2051/4885ALDH1A1 1594/4885

“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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