SCHEMBL554428

SCHEMBL554428

CCCCCn1c2ccccc2c2cc3c(cc21)c1ccccc1n3CCCCC

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 12/20 0.63
PSEN1 P49768 7/20 0.60
PSEN2 P49810 7/20 0.60
APH1B Q8WW43 7/20 0.60
NCSTN Q92542 7/20 0.60
APH1A Q96BI3 7/20 0.60
PSENEN Q9NZ42 7/20 0.60
PGR P06401 1/20 0.58
RORA P35398 1/20 0.58
RORC P51449 1/20 0.58
RORB Q92753 1/20 0.58
CNR1 P21554 1/20 0.56

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
SCHEMBL14107129 0.98 PSEN1 (0.62) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL551644 0.98 PSEN1 (0.62) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL9976723 0.98 PSEN1 (0.62) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL9905344 0.98 PSEN1 (0.62) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL278343 0.93 PGR (0.66) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL14107127 0.91 PSEN1 (0.59) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL6275417 0.91 PGR (0.64) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL1001993 0.91 PGR (0.64) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL6278388 0.91 PGR (0.64) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL750975 0.91 PGR (0.64) CNR2PSEN1PSEN2APH1BNCSTN

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140088313-A1 SUBSTITUTED INDOLOCARBAZOLES XEROX CORPORATION (US) 2014-03-27 US disclosed
US-8609867-B2 Substituted indolocarbazoles XEROX CORPORATION (US) 2013-12-17 US disclosed
US-20120157689-A1 SUBSTITUTED INDOLOCARBAZOLES XEROX CORPORATION (US) 2012-06-21 US disclosed
US-8110690-B2 Substituted indolocarbazoles XEROX CORPORATION (US) 2012-02-07 US disclosed
US-20090036689-A1 SUBSTITUTED INDOLOCARBAZOLES XEROX CORPORATION (US) 2009-02-05 US disclosed
US-7456424-B2 Thin film transistors including indolocarbozoles XEROX CORPORATION (US) 2008-11-25 US disclosed
US-20060124923-A1 Thin film transistors including indolocarbazoles XEROX CORPORATION 2006-06-15 US disclosed
US-20060125009-A1 Thin film transistors including indolocarbazoles XEROX CORPORATION 2006-06-15 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 (2 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-20090036689-A1 SUBSTITUTED INDOLOCARBAZOLES HTR3C, HTR3A, AANAT CNR2 240/4885PSEN1 3162/4885PSEN2 1766/4885
US-20120157689-A1 SUBSTITUTED INDOLOCARBAZOLES HTR3C, HTR3A, AANAT CNR2 240/4885PSEN1 3162/4885PSEN2 1766/4885

“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.