SCHEMBL16301321

SCHEMBL16301321

COc1ccc(-c2cc3c(O)cc4c(c3cc2OC(C)O)-c2ccccc2C42CC(C)(C)CC(C)(C)C2)c(OC)c1

nearest known ligand 0.32

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PGAM1 P18669 1/20 0.32
KMT2A Q03164 4/20 0.31
ALDH1A1 P00352 3/20 0.31
MEN1 O00255 3/20 0.31
KDM4E B2RXH2 1/20 0.31
CYP3A4 P08684 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HDAC4 P56524 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
PDK2 Q15119 1/20 0.30
MAPT P10636 2/20 0.30
NPC1 O15118 1/20 0.30
PKM P14618 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
PSMD14 O00487 1/20 0.30
GAA P10253 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
SCHEMBL13868655 0.93 PDK2 (0.34) PGAM1KMT2AALDH1A1MEN1KDM4E
SCHEMBL10293306 0.93 PDK2 (0.34) PGAM1KMT2AALDH1A1MEN1KDM4E
SCHEMBL10292671 0.89 AVPR2 (0.33) PGAM1KMT2AALDH1A1MEN1KDM4E
SCHEMBL10261681 0.89 PDK2 (0.34) PGAM1KMT2AALDH1A1MEN1KDM4E
SCHEMBL16301036 0.89 ALDH1A1 (0.33) PGAM1KMT2AALDH1A1MEN1MAPT
SCHEMBL10261395 0.89 AVPR1A (0.36) PGAM1KMT2AALDH1A1MEN1KDM4E
SCHEMBL10267872 0.87 MEN1 (0.35) KMT2AALDH1A1MEN1KDM4ECYP3A4
SCHEMBL10292851 0.86 PDK2 (0.35) PGAM1KMT2AALDH1A1MEN1KDM4E
SCHEMBL13868706 0.86 ALDH1A1 (0.34) KMT2AALDH1A1MEN1KDM4ECYP3A4
SCHEMBL10262914 0.85 TTR (0.34) CYP3A4HPGDMAPT

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-8691120-B2 Chromene compound TOKUYAMA CORPORATION (JP) 2014-04-08 US disclosed
US-20120170098-A1 CHROMENE COMPOUND TOKUYAMA CORPORATION (JP) 2012-07-05 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-20120170098-A1 CHROMENE COMPOUND CRY2, CRY1, SUN2 PGAM1 2923/4885KMT2A 2494/4885ALDH1A1 2266/4885

“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.