SCHEMBL12412939

SCHEMBL12412939

Cc1ccc(-n2c3cc4c5sc6cc(C)ccc6c5n(-c5ccc(C)cc5)c4cc3c3oc4cc(C)ccc4c32)cc1

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.32
ALDH1A1 P00352 2/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HTT P42858 1/20 0.31
PPARG P37231 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30
NR2E3 Q9Y5X4 1/20 0.30
NCOR2 Q9Y618 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL12504750 0.95 ESR2 (0.35) GAAKDM4EHTT
SCHEMBL12413028 0.93 MAOB (0.30) MAOB
SCHEMBL12412800 0.92 MAOB (0.31) MAOBALDH1A1GAAHPGDKDM4E
SCHEMBL12412809 0.90 ALDH1A1 (0.33) MAOBALDH1A1GAAHPGDKDM4E
SCHEMBL12503939 0.88 ESR2 (0.34) HTT
SCHEMBL12412805 0.88 ESR2 (0.34) ALDH1A1KDM4EHTTPPARGNPSR1
SCHEMBL12412943 0.88 MAOB (0.39) MAOBALDH1A1GAAHPGDKDM4E
SCHEMBL12412937 0.86 SMN1; SMN2 (0.35) ALDH1A1GAAKDM4EHTTNPSR1
SCHEMBL12504728 0.86 ESR2 (0.35) HTT
SCHEMBL12412940 0.85 KDM4E (0.30) ALDH1A1KDM4EHTT

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-20110166362-A1 NOVEL COMPOUND AND ORGANIC SEMICONDUCTOR MATERIAL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-07-07 US disclosed
US-20110166362-A1 NOVEL COMPOUND AND ORGANIC SEMICONDUCTOR MATERIAL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-07-07 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-20110166362-A1 NOVEL COMPOUND AND ORGANIC SEMICONDUCTOR MATERIAL SCLY, MSRB3, SOD1 MAOB 180/4885ALDH1A1 2760/4885GAA 4553/4885

“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.