SCHEMBL12299730

SCHEMBL12299730

Cc1cc(S)cc(C)c1OC(=O)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 2/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ GAA P10253 2/20 0.38
▸ ALOX15 P16050 1/20 0.37
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ ADRB2 P07550 1/20 0.33
▸ ADRA2A P08913 1/20 0.33
▸ DRD2 P14416 1/20 0.33
▸ ADRA2C P18825 1/20 0.33
▸ DRD1 P21728 1/20 0.33
▸ ADRA1A P35348 1/20 0.33
▸ DRD3 P35462 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.32
▸ TAS1R3 Q7RTX0 1/20 0.32
▸ TAS1R1 Q7RTX1 1/20 0.32
▸ HTT P42858 2/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ TP53 P04637 1/20 0.31

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
SCHEMBL16788648 0.84 ELANE (0.41) ELANEL3MBTL1GAAALOX15MEN1
SCHEMBL14384031 0.78 ALOX15 (0.41) ELANEL3MBTL1GAAALOX15MEN1
SCHEMBL12299731 0.78 KDM4E (0.49) GAAALOX15HTTKDM4EMAPT
SCHEMBL24394204 0.76 L3MBTL1 (0.62) ELANEL3MBTL1MEN1KMT2AKDM4E
SCHEMBL12299728 0.73 ACHE (0.42) ELANEL3MBTL1GAAALOX15MEN1
SCHEMBL17938429 0.70 ALOX15 (0.39) ELANEGAAALOX15MEN1KMT2A
SCHEMBL12257146 0.70 ELANE (0.42) ELANENPSR1MAPTALDH1A1
SCHEMBL9643543 0.70 ABCB11 (0.41) ELANEL3MBTL1GAAALOX15MEN1
SCHEMBL19105004 0.70 ELANE (0.37) ELANEL3MBTL1GAAALOX15MEN1
SCHEMBL30003194 0.69 HTT (0.65) ELANEL3MBTL1GAAALOX15MEN1

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-8012672-B2 Sulphonium salt photoinitiators BASF SE (DE) 2011-09-06 — — US disclosed
US-20100087563-A1 SULPHONIUM SALT PHOTOINITIATORS BASF SE (DE) 2010-04-08 — — 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-20100087563-A1 SULPHONIUM SALT PHOTOINITIATORS SULT1A1, NCOR1, ARSA ELANE 1896/4885L3MBTL1 172/4885GAA 4300/4885

“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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