SCHEMBL13633789

SCHEMBL13633789

CCc1nc(-c2ccc(C)o2)oc1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.51
ALDH1A1 P00352 8/20 0.51
LMNA P02545 3/20 0.51
PKM P14618 2/20 0.51
GAA P10253 2/20 0.48
RAB9A P51151 5/20 0.41
MAPT P10636 4/20 0.41
HPGD P15428 4/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
NPC1 O15118 3/20 0.39
TSHR P16473 2/20 0.39
HSD17B10 Q99714 2/20 0.39
KDM1A O60341 2/20 0.35
TDP1 Q9NUW8 1/20 0.34
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34
KMT2A Q03164 1/20 0.34
KAT8 Q9H7Z6 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
SCHEMBL1052616 0.84 KDM4E (0.47) KDM4EALDH1A1LMNAPKMGAA
SCHEMBL13633904 0.77 KDM4E (0.43) KDM4EALDH1A1LMNAPKMGAA
SCHEMBL13633777 0.76 DRD2 (0.49) KDM4EALDH1A1LMNAPKMGAA
SCHEMBL13503414 0.73 TARBP2 (0.53) KDM4EALDH1A1LMNARAB9AMAPT
SCHEMBL266619 0.73 KDM4E (0.66) KDM4ELMNARAB9AHPGDNPC1
SCHEMBL9097470 0.70 ESR1 (0.50) KDM4ERAB9AMAPTHPGDSMN1; SMN2
SCHEMBL12961041 0.70 ALDH1A1 (0.52) KDM4EALDH1A1RAB9AMAPTNPC1
SCHEMBL13633776 0.70 ALDH1A1 (0.54) KDM4EALDH1A1LMNAGAARAB9A
SCHEMBL13179907 0.70 HSD17B10 (0.58) KDM4EALDH1A1LMNARAB9AMAPT
SCHEMBL13633897 0.69 KDM4E (0.57) KDM4EALDH1A1LMNARAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090275565-A1 Substituted aralkyl derivatives CADILA HEALTHCARE LIMITED (IN) 2009-11-05 US disclosed
US-20090275565-A1 Substituted aralkyl derivatives CADILA HEALTHCARE LIMITED (IN) 2009-11-05 US disclosed
EP-1569916-B1 SUBSTITUTED ARALKYL DERIVATIVES CADILA HEALTHCARE LTD (IN) 2009-01-07 EP 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-20090275565-A1 Substituted aralkyl derivatives UGT1A7, UGT1A10, UGT2B7 KDM4E 4614/4885ALDH1A1 1255/4885LMNA 751/4885

“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.