SCHEMBL21164748

SCHEMBL21164748

Cc1cccc2c1-c1ccc(-c3cccc4c3oc3ccccc34)cc1C2(c1ccccc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.47
GGPS1 O95749 1/20 0.37
PRKDC P78527 4/20 0.37
PTGES2 Q9H7Z7 1/20 0.37
PDK2 Q15119 3/20 0.34
PGR P06401 1/20 0.32
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 1/20 0.31
ATM Q13315 1/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP2C19 P33261 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
HTT P42858 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL21742872 0.91 ALOX5 (0.49) ALOX5GGPS1PRKDCPTGES2PDK2
SCHEMBL15682270 0.88 ALOX5 (0.46) ALOX5GGPS1PRKDCPTGES2PGR
SCHEMBL18086161 0.87 ALOX5 (0.54) ALOX5GGPS1PRKDCPTGES2PDK2
SCHEMBL20277499 0.87 ALOX5 (0.57) ALOX5GGPS1PRKDCPTGES2PRMT5
SCHEMBL31511490 0.87 ALOX5 (0.56) ALOX5GGPS1PRKDCPTGES2PDK2
SCHEMBL15552528 0.87 ALOX5 (0.56) ALOX5GGPS1PRKDCPTGES2PDK2
SCHEMBL21742671 0.85 ALOX5 (0.50) ALOX5GGPS1PRKDCPTGES2PDK2
SCHEMBL18086151 0.84 ALOX5 (0.51) ALOX5GGPS1PRKDCPTGES2PDK2
SCHEMBL24434074 0.82 ALOX5 (0.40) ALOX5GGPS1PRKDCPTGES2PDK2
SCHEMBL15551283 0.82 ALOX5 (0.42) ALOX5GGPS1PRKDCPTGES2PRMT5

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-10355217-B2 Compounds and organic electronic devices MERCK PATENT GMBH (DE) 2019-07-16 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-10355217-B2 Compounds and organic electronic devices ETV6, AFF2, CYP2C19 ALOX5 953/4885GGPS1 576/4885PRKDC 1300/4885

“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.