SCHEMBL19269103

SCHEMBL19269103

Cc1c(-c2ccc(-c3cncnc3)cc2)cc(-n2c3ccc(N(c4ccccc4)c4ccccc4)cc3c3cc(N(c4ccccc4)c4ccccc4)ccc32)cc1-c1ccc(-c2cncnc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.35
▸ ICMT O60725 1/20 0.32
▸ EDNRA P25101 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ CLK4 Q9HAZ1 1/20 0.31
▸ KDM1A O60341 1/20 0.30
▸ ADK P55263 1/20 0.30
▸ APP P05067 1/20 0.30

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
SCHEMBL19269220 0.97 ATM (0.33) ATMICMTKDM1A
SCHEMBL19270861 0.89 KDM4E (0.34) ATMICMTKDM1AAPP
SCHEMBL19269984 0.89 RAC2 (0.32) ATMKDM1A
SCHEMBL19269876 0.87 KDM4E (0.34) ATMKDM1AAPP
SCHEMBL20413209 0.87 ATM (0.41) ATMICMTALDH1A1CYP1A2CYP3A4
SCHEMBL19268525 0.87 ATM (0.33) ATMICMTAPP
SCHEMBL19269527 0.86 KDM4E (0.32) ATMKDM1A
SCHEMBL19269378 0.86 KDM4E (0.32) ATMKDM1A
SCHEMBL19268530 0.85 ICMT (0.33) ATMICMTAPP
SCHEMBL19269231 0.85 ATM (0.33) ATMICMTEDNRA

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-20170244049-A1 ORGANIC LIGHT-EMITTING DIODE MATERIALS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2017-08-24 — — 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-20170244049-A1 ORGANIC LIGHT-EMITTING DIODE MATERIALS CYBA, DDT, DRD1 ATM 1981/4885ICMT 86/4885EDNRA 2574/4885

“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.

Send feedback