SCHEMBL23920635

SCHEMBL23920635

CC(C)C(C)c1ccc2sc3cc(-c4ccccc4)ccc3c2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 2/20 0.37
PIM3 Q86V86 1/20 0.36
MMP12 P39900 2/20 0.36
MMP13 P45452 2/20 0.36
PTGS2 P35354 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
F9 P00740 2/20 0.35
PIK3CA P42336 1/20 0.34
PI4KA P42356 1/20 0.34
PI4KB Q9UBF8 1/20 0.34
ROCK1 Q13464 1/20 0.33
GPR3 P46089 1/20 0.32
PTPN7 P35236 1/20 0.32
DUSP3 P51452 1/20 0.32
PTPN12 Q05209 1/20 0.32
PTPN22 Q9Y2R2 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
SCHEMBL19979629 0.84 GPR3 (0.44) LIMK1PIM3MMP12MMP13ALDH1A1
SCHEMBL23719235 0.83 GPR3 (0.50) MMP12MMP13ALDH1A1MAPTHPGD
SCHEMBL19387226 0.83 GPR3 (0.50) MMP12MMP13ALDH1A1MAPTHPGD
SCHEMBL9942169 0.81 PIM3 (0.49) LIMK1PIM3ALDH1A1MAPTHPGD
SCHEMBL28796958 0.81 PIM3 (0.49) LIMK1PIM3ALDH1A1MAPTHPGD
SCHEMBL14295228 0.80 RXRA (0.44) LIMK1PTGS2ALDH1A1MAPTHPGD
SCHEMBL24245992 0.80 RXRA (0.44) LIMK1PTGS2ALDH1A1MAPTHPGD
SCHEMBL14295237 0.80 RXRA (0.44) LIMK1PIM3PTGS2MAPTRAB9A
SCHEMBL25721015 0.80 ALDH1A1 (0.50) MMP12MMP13ALDH1A1MAPTHPGD
SCHEMBL24701327 0.79 UGT2B7 (0.36) MMP12MMP13ALDH1A1MAPTHPGD

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-20220356193-A1 PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2022-11-10 US disclosed
US-20210320263-A1 ORGANIC ELECTROLUMINESCENT COMPOUND, A PLURALITY OF HOST MATERIALS, AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2021-10-14 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-20220356193-A1 PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME PIEZO1, SOD1, NECTIN4 LIMK1 64/4885PIM3 3158/4885MMP12 3248/4885

“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.