SCHEMBL23965711

SCHEMBL23965711

CC(=N)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.60
MAPT P10636 3/20 0.60
WDR5 P61964 1/20 0.60
L3MBTL1 Q9Y468 2/20 0.48
MMP3 P08254 1/20 0.46
BCL2L1 Q07817 1/20 0.46
NQO2 P16083 5/20 0.46
HPGD P15428 2/20 0.45
ALDH1A1 P00352 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
CTDSP1 Q9GZU7 1/20 0.45
PDCD1 Q15116 1/20 0.44
CD274 Q9NZQ7 1/20 0.44

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
SCHEMBL26081558 0.91 MAPT (0.52) SMN1; SMN2MAPTWDR5L3MBTL1NQO2
SCHEMBL1148180 0.84
SCHEMBL19534179 0.83 MEN1 (0.61) MAPTL3MBTL1HPGDALDH1A1
SCHEMBL22514309 0.81 PRSS1 (0.50) SMN1; SMN2MAPTWDR5MMP3BCL2L1
SCHEMBL18644564 0.81 NOS3 (0.39) MAPTL3MBTL1HPGDALDH1A1RAB9A
SCHEMBL16902370 0.81 PRSS1 (0.60) SMN1; SMN2MAPTWDR5
SCHEMBL13754825 0.79 PRSS1 (0.64) SMN1; SMN2MAPTWDR5
SCHEMBL40527 0.79 SMN1; SMN2 (0.65) SMN1; SMN2MAPTWDR5L3MBTL1MMP3
SCHEMBL23268269 0.78 HSD17B1 (0.37) SMN1; SMN2MAPTWDR5NQO2HPGD
SCHEMBL26081554 0.78 PRSS1 (0.62) SMN1; SMN2MAPTWDR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11552258-B2 Organic light-emitting device comprising emission layer satisfying specific singlet excitation energy level conditions SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-01-10 US disclosed
EP-3764416-B1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO LTD (KR) 2022-01-26 EP disclosed
EP-3903583-A1 USE OF STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI CONTAINING AN AMINO ACID SUBSTITUTION F129L IN THE MITOCHONDRIAL CYTOCHROME B PROTEIN CONFERRING RESISTANCE TO QO INHIBITORS III BASF SE (DE) 2021-11-03 EP disclosed
EP-3903581-A1 USE OF STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI CONTAINING AN AMINO ACID SUBSTITUTION F129L IN THE MITOCHONDRIAL CYTOCHROME B PROTEIN CONFERRING RESISTANCE TO QO INHIBITORS I BASF SE (DE) 2021-11-03 EP 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-11552258-B2 Organic light-emitting device comprising emission layer satisfying specific singlet excitation energy level conditions EML4, NES, TBL2 SMN1; SMN2 1179/4885MAPT 141/4885WDR5 2389/4885

“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.