SCHEMBL21157071

SCHEMBL21157071

Cc1cc(-c2ccccc2-c2ccccc2-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)c2oc3c(-c4ccccc4-c4ccccc4-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)cc(C)cc3c2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NUDT1 P36639 1/20 0.40
METAP2 P50579 1/20 0.36
MAOB P27338 1/20 0.35
ALDH1A1 P00352 3/20 0.35
HPGD P15428 3/20 0.35
KDM4E B2RXH2 2/20 0.35
MAPT P10636 2/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
HSD17B10 Q99714 1/20 0.35
IDH1 O75874 1/20 0.35
PARP1 P09874 1/20 0.34
PRKDC P78527 2/20 0.33
PSMB5 P28074 2/20 0.33
TSHR P16473 3/20 0.33
CA12 O43570 2/20 0.33
CA9 Q16790 2/20 0.33
TNF P01375 1/20 0.33
NOD2 Q9HC29 1/20 0.33
NOD1 Q9Y239 1/20 0.33

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
SCHEMBL21157814 1.00 NUDT1 (0.40) NUDT1METAP2MAOBALDH1A1HPGD
SCHEMBL21157905 0.85 NUDT1 (0.44) NUDT1METAP2MAOBALDH1A1HPGD
SCHEMBL21157067 0.80 NUDT1 (0.43) NUDT1METAP2MAOBALDH1A1HPGD
SCHEMBL21156614 0.80 NUDT1 (0.43) NUDT1METAP2MAOBALDH1A1HPGD
SCHEMBL21157073 0.80 ALDH1A1 (0.36) ALDH1A1MAPTPRKDCNPC1RAB9A
SCHEMBL21157808 0.80 ALDH1A1 (0.36) ALDH1A1MAPTPRKDCNPC1RAB9A
SCHEMBL21157813 0.80 PRKDC (0.45) ALDH1A1HPGDKDM4EMAPTTP53
SCHEMBL21157074 0.80 PRKDC (0.45) ALDH1A1HPGDKDM4EMAPTTP53
SCHEMBL430107 0.78 SMN1; SMN2 (0.40) NUDT1ALDH1A1HPGDKDM4EMAPT
SCHEMBL21157897 0.77 METAP2 (0.36) NUDT1METAP2ALDH1A1KDM4EMAPT

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-20190214577-A1 THERMALLY ACTIVATED DELAYED FLUORESCENCE MATERIAL, POLYMER, MIXTURE, FORMULATION, AND ORGANIC ELECTRONIC DEVICE GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2019-07-11 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-20190214577-A1 THERMALLY ACTIVATED DELAYED FLUORESCENCE MATERIAL, POLYMER, MIXTURE, FORMULATION, AND ORGANIC ELECTRONIC DEVICE TEAD2, TEAD3, TEAD1 NUDT1 1200/4885METAP2 4724/4885MAOB 461/4885

“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.