SCHEMBL24401494

SCHEMBL24401494

Nc1cccnc1Nc1cc(Nc2ncccc2N)cc(C(F)(F)F)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 3/20 0.53
LMNA P02545 3/20 0.51
AR P10275 1/20 0.51
ALDH1A1 P00352 2/20 0.49
MEN1 O00255 1/20 0.49
GMNN O75496 1/20 0.49
TTR P02766 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
PKM P14618 1/20 0.49
NFKB1 P19838 1/20 0.49
UGT1A1 P22309 1/20 0.49
PTGS1 P23219 1/20 0.49
PTGS2 P35354 1/20 0.49
PMP22 Q01453 1/20 0.49
DHODH Q02127 1/20 0.49
KMT2A Q03164 1/20 0.49
TEAD4 Q15561 1/20 0.49
HIF1A Q16665 1/20 0.49

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
SCHEMBL29532275 1.00 GRM4 (0.53) GRM4LMNAARALDH1A1MEN1
SCHEMBL6799074 0.88 LMNA (0.66) GRM4LMNAARALDH1A1MEN1
SCHEMBL12222340 0.79 GRM4 (0.54) GRM4LMNADHODHCA12CA1
SCHEMBL22542884 0.76 GRM4 (0.53) GRM4LMNAARALDH1A1MEN1
SCHEMBL29531950 0.76 MAPT (0.55) GRM4LMNAARALDH1A1MEN1
SCHEMBL11165882 0.76 LMNA (0.41) GRM4LMNAARALDH1A1MEN1
SCHEMBL24401492 0.76 TUBB4A (0.50) GRM4LMNAARALDH1A1MEN1
SCHEMBL29531777 0.76 TUBB4A (0.50) GRM4LMNAARALDH1A1MEN1
SCHEMBL15965815 0.75 CA12 (0.49) GRM4LMNACA12CA1CA2
SCHEMBL19851118 0.74 CA12 (0.63) GRM4LMNAALDH1A1MEN1CYP1A2

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-20220140258-A1 IRIDIUM COMPLEX, NITROGEN-CONTAINING TRIDENTATE CARBENE CHELATE, AND ORGANIC LIGHT-EMITTING DIODE NATIONAL TSING HUA UNIVERSITY (TW) 2022-05-05 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-20220140258-A1 IRIDIUM COMPLEX, NITROGEN-CONTAINING TRIDENTATE CARBENE CHELATE, AND ORGANIC LIGHT-EMITTING DIODE NR2E3, CHRM1, CBR3 GRM4 248/4885LMNA 3381/4885AR 1293/4885

“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.