SCHEMBL5521348

SCHEMBL5521348

COc1ccc(C2(c3ccc(OC)cc3)C=Cc3c4c(c5ccc(C)cc5c3O2)-c2ccc(C)cc2C4(C)OC)cc1

nearest known ligand 0.31

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
CYP2C9 P11712 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
CYP2C19 P33261 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MAPT P10636 1/20 0.31
ATM Q13315 1/20 0.31
IDO1 P14902 2/20 0.31
MAOB P27338 1/20 0.30

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
SCHEMBL30476316 0.91 KDM4E (0.32) KDM4EMEN1ALDH1A1LMNACYP2C9
SCHEMBL25836099 0.90 KDM4E (0.31) KDM4EMEN1ALDH1A1LMNACYP2C9
SCHEMBL20978611 0.90 MAOB (0.30) MAOB
SCHEMBL30750677 0.90 KDM4E (0.31) KDM4EMEN1ALDH1A1LMNACYP2C9
SCHEMBL2799268 0.90 KDM4E (0.31) KDM4EMEN1ALDH1A1LMNACYP2C9
SCHEMBL13988267 0.89
SCHEMBL25844695 0.89 KDM4E (0.35) KDM4EMEN1ALDH1A1LMNACYP2C9
SCHEMBL3996603 0.88
SCHEMBL16639209 0.87
SCHEMBL15214815 0.87

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070278461-A1 PHOTOCHROMIC MATERIALS COMPRISING HALOALKYL GROUPS TRANSITIONS OPTICAL, INC. (US) 2007-12-06 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-20070278461-A1 PHOTOCHROMIC MATERIALS COMPRISING HALOALKYL GROUPS TELO2, EYA3, CRY2 KDM4E 2611/4885MEN1 4496/4885ALDH1A1 2841/4885

“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.