SCHEMBL13428117

SCHEMBL13428117

c1ccc2c(c1)CCc1ccccc1N2c1ccc2c(-c3ccc(-c4ccc5ccccc5c4)cc3)c3cc(N4c5ccccc5CCc5ccccc54)ccc3c(-c3ccc(-c4ccc5ccccc5c4)cc3)c2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C19 P33261 1/20 0.38
ESR1 P03372 2/20 0.36
ESR2 Q92731 2/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
RAB9A P51151 2/20 0.35
HSP90AA1 P07900 1/20 0.34
HSD17B3 P37058 1/20 0.34
KDM4E B2RXH2 2/20 0.33
MAPT P10636 2/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
HTR3A P46098 1/20 0.33
ALOX5 P09917 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
SCHEMBL13428157 0.99 ALDH1A1 (0.37) ALDH1A1LMNACYP1A2CYP2C9HPGD
SCHEMBL13008419 0.97 HSD17B3 (0.38) ALDH1A1LMNACYP1A2CYP2C9HPGD
SCHEMBL13008422 0.95 CYP1A2 (0.36) ALDH1A1LMNACYP1A2CYP2C9HPGD
SCHEMBL13009032 0.95 HSD17B3 (0.38) ALDH1A1LMNACYP1A2CYP2C9HPGD
SCHEMBL12175900 0.95 ALDH1A1 (0.38) ALDH1A1LMNACYP1A2CYP2C9HPGD
SCHEMBL13428311 0.95 CYP1A2 (0.39) ALDH1A1LMNACYP1A2CYP2C9HPGD
SCHEMBL13009021 0.95 CYP1A2 (0.39) ALDH1A1LMNACYP1A2CYP2C9HPGD
SCHEMBL13008870 0.94 CYP1A2 (0.37) ALDH1A1LMNACYP1A2CYP2C9HPGD
SCHEMBL13428138 0.94 CYP1A2 (0.37) ALDH1A1LMNACYP1A2CYP2C9HPGD
SCHEMBL13428149 0.94 HSD17B3 (0.38) ALDH1A1LMNACYP1A2CYP2C9HPGD

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-20100051106-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-03-04 US disclosed
US-20100051106-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-03-04 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-20100051106-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same RPL36, RPL39, RPL36A ALDH1A1 1477/4885LMNA 4186/4885CYP1A2 2199/4885

“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.