SCHEMBL3965834

SCHEMBL3965834

[c]1ccc(-c2cccc3oc4ccccc4c23)c(SCc2ccccc2)c1SCc1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.36
ATM Q13315 1/20 0.36
NPSR1 Q6W5P4 3/20 0.33
TSHR P16473 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
PPARG P37231 1/20 0.33
NCOA2 Q15596 1/20 0.33
NCOA1 Q15788 1/20 0.33
NCOA3 Q9Y6Q9 1/20 0.33
POLB P06746 1/20 0.33
PKM P14618 1/20 0.33
HPGD P15428 2/20 0.33
MAPK1 P28482 2/20 0.33
CREBBP Q92793 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
ELANE P08246 2/20 0.32
TDP1 Q9NUW8 3/20 0.32
ALDH1A1 P00352 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL15842809 0.75 L3MBTL1 (0.39) MAPTNPSR1MEN1KMT2APOLB
SCHEMBL3081231 0.69 ALDH1A1 (0.52) MAPTATMTSHRMEN1KMT2A
SCHEMBL30550556 0.69 ALDH1A1 (0.52) MAPTATMTSHRMEN1KMT2A
SCHEMBL16670035 0.67 ALDH1A1 (0.50) MAPTATMTSHRMEN1KMT2A
SCHEMBL28701250 0.67 ALOX5 (0.39) MAPTHPGDALDH1A1NPC1RAB9A
SCHEMBL6050865 0.67 MAPT (0.38) MAPTATMNPSR1TSHRMEN1
SCHEMBL6050913 0.67 MEN1 (0.31) MAPTNPSR1MEN1KMT2APOLB
SCHEMBL1247110 0.66 TDP1 (0.40) MAPTNPSR1MEN1KMT2APPARG
SCHEMBL29036489 0.66 HPGD (0.38) MAPTMEN1KMT2AHPGDTDP1
SCHEMBL7530192 0.65 ALDH1A1 (0.43) MAPTATMTSHRMEN1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4240718-A1 MATERIALS FOR ELECTRONIC DEVICES Merck Patent GmbH (DE) 2023-09-13 EP disclosed
US-7598236-B2 Diazabicyclic central nervous system active agents ABBOTT LABORATORIES (US) 2009-10-06 US disclosed
US-20080097094-A1 DIAZABICYCLIC CENTRAL NERVOUS SYSTEM ACTIVE AGENTS ABBOTT LABORATORIES (US) 2008-04-24 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-20080097094-A1 DIAZABICYCLIC CENTRAL NERVOUS SYSTEM ACTIVE AGENTS GAP43, GABRE, CHRNA6 MAPT 1101/4885ATM 3582/4885NPSR1 253/4885

“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.