SCHEMBL13556860

SCHEMBL13556860

c1ccc2c(-n3c4ccncc4c4c5ccccc5c5c(c6ccccc6c6c7cnccc7n(-c7cccc8ccccc78)c65)c43)cccc2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ TNF P01375 1/20 0.40
▸ MAOA P21397 4/20 0.37
▸ MAOB P27338 4/20 0.37
▸ ACHE P22303 1/20 0.37
▸ P2RX7 Q99572 1/20 0.36
▸ HTR3E A5X5Y0 1/20 0.36
▸ HTR3B O95264 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ HTR1A P08908 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ NCF1 P14598 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ HTR1D P28221 1/20 0.36
▸ HTR1B P28222 1/20 0.36
▸ HTR2A P28223 1/20 0.36
▸ HTR7 P34969 1/20 0.36
▸ MTOR P42345 1/20 0.36

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
SCHEMBL13556864 0.86 MAOA (0.40) TNFMAOAMAOBACHECYP1A2
SCHEMBL13556865 0.83 KDM4E (0.41) MAPK1TNFMAOAMAOBACHE
SCHEMBL2627576 0.82 HSD17B10 (0.43) NPC1MAPK1HTR3EHTR3BCYP1A2
SCHEMBL13556868 0.80 TNF (0.49) NPC1MAPK1TNFHSD17B10ALDH1A1
SCHEMBL13556863 0.80 KDM4E (0.44) MAOAMAOBACHECYP1A2TOP2A
SCHEMBL17989957 0.79 TNF (0.39) TNFMAOAMAOBACHECYP1A2
SCHEMBL24768829 0.79 TOP2A (0.34) NPC1MAPK1TNFP2RX7HSD17B10
SCHEMBL20312035 0.78 HSD17B10 (0.40) NPC1MAPK1HTR3EHTR3BCYP1A2
SCHEMBL24767803 0.76 TDP1 (0.38) ACHECYP1A2TOP2ATDP1
SCHEMBL14013692 0.76 TDP1 (0.44) NPC1MAPK1HTR3EHTR3BCYP1A2

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-8889270-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2014-11-18 — — US disclosed
US-8889270-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2014-11-18 — — US disclosed
US-20120267613-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2012-10-25 — — US disclosed
US-20120267613-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2012-10-25 — — 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-20120267613-A1 ORGANIC LIGHT-EMITTING DEVICE CRY1, CYP1A1, CRY2 NPC1 3388/4885MAPK1 1699/4885TNF 1486/4885

“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.

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