SCHEMBL6078738

SCHEMBL6078738

CC(C)C(=O)Nc1cc(Cl)ccc1O

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNMA1 Q12791 13/20 0.58
POLB P06746 1/20 0.58
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
HPGD P15428 2/20 0.57
LMNA P02545 2/20 0.57
NPC1 O15118 1/20 0.57
TP53 P04637 1/20 0.57
MAPT P10636 1/20 0.57
HTT P42858 1/20 0.57
RAB9A P51151 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
GAA P10253 3/20 0.51
CHRNA7 P36544 1/20 0.50
KDM4E B2RXH2 1/20 0.50
HIF1A Q16665 1/20 0.50

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
SCHEMBL9792728 0.84 KCNMA1 (0.60) KCNMA1POLBMEN1KMT2AHPGD
SCHEMBL14254815 0.84 LMNA (0.62) POLBMEN1KMT2AHPGDLMNA
SCHEMBL4968141 0.84 KCNMA1 (0.53) KCNMA1POLBMEN1KMT2AHPGD
SCHEMBL28295632 0.83 KCNMA1 (0.68) KCNMA1POLBMEN1KMT2AHPGD
SCHEMBL7256022 0.83 KCNMA1 (0.55) KCNMA1POLBMEN1KMT2AHPGD
SCHEMBL19910569 0.83 LMNA (0.62) POLBMEN1KMT2ALMNAMAPT
SCHEMBL17845364 0.83 ALDH1A1 (0.49) MEN1KMT2ALMNATP53MAPT
SCHEMBL7254163 0.81 KCNMA1 (0.60) KCNMA1POLBMEN1KMT2AHPGD
SCHEMBL14254797 0.81 ALDH1A1 (0.55) MEN1KMT2AHPGDLMNANPC1
SCHEMBL14354719 0.81 GAA (0.72) KCNMA1POLBMEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7005439-B2 Compounds ASTRAZENECA AB (SE) 2006-02-28 US disclosed
US-20050239801-A1 Novel compounds ASTRAZENECA AB (SE) 2005-10-27 US disclosed
EP-1299356-B1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2004-02-11 EP disclosed
CN-1447794-A Novel compounds ASTRAZENECA AB (SE) 2003-10-08 CN disclosed
US-20030153555-A1 Novel compounds ASTRAZENECA AB (SE) 2003-08-14 US disclosed
EP-1299356-A1 NOVEL COMPOUNDS AstraZeneca AB (SE) 2003-04-09 EP disclosed
WO-2001098272-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2001-12-27 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 (2 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-20030153555-A1 Novel compounds RPS4Y1, RPS4X, UGT2B7 KCNMA1 2480/4885POLB 4533/4885MEN1 272/4885
US-20050239801-A1 Novel compounds CHRM2, CHRM1, C1R KCNMA1 1640/4885POLB 4323/4885MEN1 76/4885

“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.