SCHEMBL4026252

SCHEMBL4026252

CC(C)(C)[Si](C)(C)OCCCC(C(=O)O)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 4/20 0.41
AKR1C2 P52895 4/20 0.41
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
FFAR1 O14842 1/20 0.35
CYP26A1 O43174 1/20 0.35
DUT P33316 1/20 0.34

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
SCHEMBL5321208 0.81 LMNA (0.40) AKR1C3AKR1C2ALDH1A1LMNA
SCHEMBL12497714 0.76 PNMT (0.34)
SCHEMBL6996088 0.75 SLC6A2 (0.41)
SCHEMBL6123335 0.75 ALDH1A1 (0.44) AKR1C3AKR1C2ALDH1A1LMNAHTT
SCHEMBL6123334 0.75 ALDH1A1 (0.44) AKR1C3AKR1C2ALDH1A1LMNAHTT
SCHEMBL4025402 0.75 AKR1C3 (0.44) AKR1C3AKR1C2ALDH1A1LMNAHTT
SCHEMBL3831904 0.75 ACHE (0.44) AKR1C3AKR1C2ALDH1A1
SCHEMBL23485806 0.74 CYP2C19 (0.41) LMNASMN1; SMN2
SCHEMBL9000480 0.74 AKR1C3 (0.47) AKR1C3AKR1C2ALDH1A1LMNAHTT
SCHEMBL31489975 0.74 AKR1C3 (0.47) AKR1C3AKR1C2ALDH1A1LMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1497265-B1 COMPOUNDS HAVING AFFINITY AT 5HT2C RECEPTOR AND USE THEREOF IN THERAPY GLAXO GROUP LTD (GB) 2009-02-18 EP disclosed
US-20050203079-A1 Compounds having affinity at 5ht2C receptor and use thereof in therapy GLAXO GROUP LIMITED 2005-09-15 US disclosed
EP-1497265-A1 COMPOUNDS HAVING AFFINITY AT 5HT2C RECEPTOR AND USE THEREOF IN THERAPY GLAXO GROUP LIMITED (GB) 2005-01-19 EP disclosed
WO-2003089409-A1 COMPOUNDS HAVING AFFINITY AT 5HT2C RECEPTOR AND USE THEREOF IN THERAPY GLAXO GROUP LIMITED (GB) 2003-10-30 WO 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-20050203079-A1 Compounds having affinity at 5ht2C receptor and use thereof in therapy HTR7, HTR2C, HTR3C AKR1C3 296/4885AKR1C2 478/4885ALDH1A1 1439/4885

“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.