SCHEMBL6301363

SCHEMBL6301363

COc1cccc(C2=NC(C)(C)CO2)c1C(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.42
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
RAB9A P51151 2/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40
NPC1 O15118 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PKM P14618 1/20 0.39
MAPT P10636 4/20 0.38
ALDH1A1 P00352 1/20 0.38
STK10 O94804 1/20 0.38
SLK Q9H2G2 1/20 0.38
LMNA P02545 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
TP53 P04637 1/20 0.37

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
SCHEMBL540 0.80 KDM4E (0.50) KDM4EMEN1KMT2ARAB9ANPC1
SCHEMBL29527964 0.80 KDM4E (0.50) KDM4EMEN1KMT2ARAB9ANPC1
SCHEMBL10737493 0.78 KDM4E (0.47) KDM4EMEN1KMT2ARAB9ANPC1
SCHEMBL6587245 0.78 ALDH1A1 (0.49) KDM4EKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL11487649 0.78 KDM4E (0.46) KDM4ERAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL8702015 0.77 KMT2A (0.46) KDM4EMEN1KMT2AGAAIL2
SCHEMBL6299778 0.77 KDM4E (0.50) KDM4ERAB9ANPC1SMN1; SMN2MAPT
SCHEMBL9702416 0.77 KDM4E (0.50) KDM4EALDH1A1ATMIL2
SCHEMBL8702016 0.76 KMT2A (0.43) KDM4EKMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL9364445 0.75 KDM4E (0.43) KDM4EALDH1A1ATM

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-6943183-B2 5-substituted tetralones as inhibitors of ras farnesyl transferase PFIZER INC (US) 2005-09-13 US disclosed
US-20040044057-A1 5- substituted tetralones as inhibitors of ras farnesyl trransferase WARNER-LAMBERT COMPANY 2004-03-04 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-20040044057-A1 5- substituted tetralones as inhibitors of ras farnesyl trransferase PTAR1, FNTA, GGPS1 KDM4E 2646/4885MEN1 3391/4885KMT2A 3889/4885

“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.