SCHEMBL25813893

SCHEMBL25813893

CCc1ccc(-c2nc(-c3ccc(C)cc3)nc(-c3ccc(CC)cc3)n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.48
RAB9A P51151 5/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
NPC1 O15118 4/20 0.46
MAPT P10636 3/20 0.46
ALDH1A1 P00352 2/20 0.46
LMNA P02545 1/20 0.46
METAP2 P50579 1/20 0.44
POLB P06746 1/20 0.42
TDP2 O95551 3/20 0.42
CYP1A2 P05177 2/20 0.42
ADORA3 P0DMS8 2/20 0.41
ADORA1 P30542 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
HEXA P06865 1/20 0.41
HEXB P07686 1/20 0.41
DPP4 P27487 1/20 0.40
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL12621115 1.00 TP53 (0.48) TP53RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL12622359 0.98 TP53 (0.47) TP53RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL12622292 0.91 TP53 (0.55) TP53RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL12622298 0.89 TP53 (0.53) TP53RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL30026056 0.84 TP53 (0.50) TP53RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL2493917 0.84 IDO1 (0.48) TP53RAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL11810896 0.83 L3MBTL1 (0.52) RAB9ANPC1ALDH1A1LMNAMETAP2
SCHEMBL6111135 0.83 L3MBTL1 (0.52) RAB9ANPC1ALDH1A1LMNAMETAP2
SCHEMBL18627698 0.83 L3MBTL1 (0.56) TP53RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL18677008 0.83 L3MBTL1 (0.50) TP53RAB9ASMN1; SMN2NPC1MAPT

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-20230189636-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2023-06-15 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 (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-20230189636-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF EMC1, EMC2, EPCAM TP53 2352/4885RAB9A 2585/4885SMN1; SMN2 2829/4885

“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.