SCHEMBL6129286

SCHEMBL6129286

COc1ccc(C(=Cc2ccccc2)C(=O)c2ccccc2)c(OC)c1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP1B1 Q16678 1/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
POLB P06746 1/20 0.45
ALDH1A1 P00352 3/20 0.44
AKR1C1 Q04828 1/20 0.44
MAPT P10636 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALOX15 P16050 1/20 0.43
MAPK1 P28482 1/20 0.43
HSD17B10 Q99714 1/20 0.43
AKR1C2 P52895 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
TNFRSF1A P19438 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PKM P14618 1/20 0.43
TUBB1 Q9H4B7 4/20 0.42
TUBB4A P04350 1/20 0.42

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
SCHEMBL27888985 0.81 MAPT (0.51) CYP1A2MEN1KMT2AALDH1A1MAPT
SCHEMBL6129263 0.81 AKR1C2 (0.61) CYP1A2MEN1KMT2APOLBALDH1A1
SCHEMBL4864056 0.80 TUBB1 (0.49) CYP1A1CYP1A2CYP1B1MEN1KMT2A
SCHEMBL11755939 0.78 CYP1A1 (0.46) CYP1A1CYP1A2CYP1B1MEN1KMT2A
SCHEMBL2446110 0.76 MAPT (0.66) CYP1A2MEN1KMT2AALDH1A1MAPT
SCHEMBL30023422 0.76 MAPT (0.66) CYP1A2MEN1KMT2AALDH1A1MAPT
SCHEMBL8526794 0.76 PKM (0.53) CYP1A2MEN1KMT2AALDH1A1MAPT
SCHEMBL27660465 0.74 ALDH1A1 (0.48) CYP1A2MEN1KMT2AALDH1A1MAPT
SCHEMBL31436378 0.73 CYP1A1 (0.72) CYP1A1CYP1A2CYP1B1MEN1KMT2A
SCHEMBL14315253 0.73 CYP1A1 (0.72) CYP1A1CYP1A2CYP1B1MEN1KMT2A

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-20050065213-A1 Combretastatin a-4 derivatives having antineoplastic activity LAWRENCE NICHOLAS JAMES (GB) 2005-03-24 US disclosed
EP-1444190-A1 COMBRETASTATIN A-4 DERIVATIVES HAVING ANTINEOPLASTIC ACTIVITY Cancer Research Technology Limited (GB) 2004-08-11 EP disclosed
WO-2003040077-A1 COMBRETASTATIN A-4 DERIVATIVES HAVING ANTINEOPLASTIC ACTIVITY CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2003-05-15 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-20050065213-A1 Combretastatin a-4 derivatives having antineoplastic activity AURKA, AURKB, HDAC4 CYP1A1 2327/4885CYP1A2 2218/4885CYP1B1 1238/4885

“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.