SCHEMBL6311778

SCHEMBL6311778

Cc1c(C2CCNCC2)sc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
HTR2C P28335 11/20 0.46
GABRA1 P14867 1/20 0.44
GABRG2 P18507 1/20 0.44
GABRB3 P28472 1/20 0.44
SLC18A3 Q16572 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
ADRB2 P07550 1/20 0.41
HTR1A P08908 1/20 0.40
HTR2A P28223 1/20 0.39
KCNH2 Q12809 1/20 0.39

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
SCHEMBL6313007 0.80 MEN1 (0.43) MEN1KMT2AHTR2CGABRA1GABRG2
SCHEMBL8591946 0.80 MEN1 (0.43) MEN1KMT2AHTR2CGABRA1GABRG2
SCHEMBL6309715 0.75 CYP2D6 (0.39) MEN1KMT2AHTR2CGABRA1GABRG2
SCHEMBL9591123 0.74 GPR3 (0.35) HTR1AHTR2A
SCHEMBL736013 0.72 OPRL1 (0.50)
SCHEMBL5758789 0.71 HTR2C (0.49) MEN1KMT2AHTR2CSLC18A3SIGMAR1
Dibenzothiophene SCHEMBL28254130 0.69 GPR3 (0.70) MEN1KMT2AHTR2C
SCHEMBL28511836 0.69 GPR3 (0.44) MEN1KMT2AGABRA1GABRG2GABRB3
SCHEMBL4676658 0.68 SLC6A4 (0.55) MEN1KMT2AHTR2CSLC18A3SIGMAR1
SCHEMBL29868908 0.68 SLC6A4 (0.55) MEN1KMT2AHTR2CSLC18A3SIGMAR1

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-6844344-B2 Benzofuran derivatives ELI LILLY AND COMPANY (US) 2005-01-18 US disclosed
US-20030232833-A1 Benzofuran derivatives ELI LILLY AND COMPANY 2003-12-18 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-20030232833-A1 Benzofuran derivatives BRD1, BPTF, HTR1F MEN1 4207/4885KMT2A 781/4885HTR2C 52/4885

“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.