SCHEMBL13502163

SCHEMBL13502163

CC(=O)c1cc2c(cc1C)[Si](c1ccccc1)(c1ccccc1)c1cc(C)c(C(C)=O)cc1-2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKR1C3 P42330 3/20 0.37
▸ AKR1C2 P52895 3/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ HPGD P15428 1/20 0.36
▸ S100A4 P26447 1/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ MAPT P10636 2/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ AKR1B10 O60218 1/20 0.35
▸ AKR1B1 P15121 1/20 0.35
▸ AKR1C4 P17516 1/20 0.35
▸ AKR1C1 Q04828 1/20 0.35

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
SCHEMBL13502235 0.87 SMN1; SMN2 (0.36) AKR1C3AKR1C2SMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL13502167 0.77 GAA (0.38) SMN1; SMN2ALDH1A1HPGDKMT2ANPC1
SCHEMBL13502164 0.77 HTT (0.43) ALDH1A1HPGDRAB9AMAPTCYP2C9
SCHEMBL13502149 0.70 — —
SCHEMBL28713805 0.69 PTGS1 (0.45) AKR1C3AKR1C2SMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL21953367 0.68 PTGS1 (0.42) SMN1; SMN2L3MBTL1ALDH1A1KMT2AMAPT
SCHEMBL14781353 0.67 KDM4E (0.50) SMN1; SMN2ALDH1A1HPGDKMT2ANPC1
SCHEMBL4403107 0.67 SMN1; SMN2 (0.52) SMN1; SMN2ALDH1A1HPGDKMT2ANPC1
SCHEMBL13502169 0.67 APP (0.38) SMN1; SMN2ALDH1A1HPGDKMT2ANPC1
SCHEMBL38660220 0.66 MYC (0.48) AKR1C3AKR1C2SMN1; SMN2ALDH1A1HPGD

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-7662478-B2 Polymer and polymer light-emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-02-16 — — US disclosed
US-20080103278-A1 NEW POLYMER AND POLYMER LIGHT-EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED 2008-05-01 — — 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-20080103278-A1 NEW POLYMER AND POLYMER LIGHT-EMITTING DEVICE USING THE SAME CRY1, ARCN1, CORO1A AKR1C3 682/4885AKR1C2 1155/4885SMN1; SMN2 3254/4885

“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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