SCHEMBL19652601

SCHEMBL19652601

Cn1c2ccccc2c2cc(Cc3ccc4c(c3)c3c5c(ccc3n4C)sc3ccccc35)ccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.40
▸ KDM4E B2RXH2 5/20 0.40
▸ HPGD P15428 4/20 0.40
▸ MAPT P10636 4/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ HSD17B10 Q99714 3/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ PABPC1 P11940 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ HCRTR1 O43613 3/20 0.36
▸ HCRTR2 O43614 3/20 0.36
▸ RXRA P19793 1/20 0.36
▸ RXRB P28702 1/20 0.36
▸ RORC P51449 1/20 0.35
▸ TRPV1 Q8NER1 1/20 0.34
▸ NQO2 P16083 1/20 0.34
▸ LMNA P02545 1/20 0.34

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
SCHEMBL21915328 0.88 GPR3 (0.46) GPR3KDM4EHPGDMAPTALDH1A1
SCHEMBL19652614 0.88 KDM4E (0.40) GPR3KDM4EHPGDMAPTALDH1A1
SCHEMBL25998127 0.86 RORA (0.37) GPR3KDM4EHPGDMAPTALDH1A1
SCHEMBL19652588 0.85 GPR3 (0.52) GPR3KDM4EHPGDMAPTALDH1A1
SCHEMBL21915323 0.85 GPR3 (0.40) GPR3KDM4EHPGDMAPTALDH1A1
SCHEMBL19652611 0.84 KDM4E (0.40) GPR3KDM4EHPGDMAPTALDH1A1
SCHEMBL13183674 0.84 GPR3 (0.48) GPR3KDM4EHPGDMAPTALDH1A1
SCHEMBL25682734 0.83 RORA (0.42) KDM4EHTTRORC
SCHEMBL19652651 0.82 HPGD (0.43) GPR3KDM4EHPGDMAPTALDH1A1
SCHEMBL19652647 0.82 HPGD (0.43) GPR3KDM4EHPGDMAPTALDH1A1

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-20170342057-A1 A PLURALITY OF HOST MATERIALS AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2017-11-30 — — 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-20170342057-A1 A PLURALITY OF HOST MATERIALS AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME TERT, TELO2, SOD1 GPR3 4741/4885KDM4E 2915/4885HPGD 4247/4885

“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.

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