SCHEMBL17284951

SCHEMBL17284951

N#Cc1ccc2oc3c4ccccc4[nH]c3c2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 1/20 0.52
▸ TDO2 P48775 2/20 0.45
▸ PIM1 P11309 1/20 0.44
▸ CSNK2A2 P19784 1/20 0.44
▸ CSNK2B P67870 1/20 0.44
▸ PIM3 Q86V86 1/20 0.44
▸ PIM2 Q9P1W9 1/20 0.44
▸ NOS3 P29474 1/20 0.43
▸ NOS1 P29475 1/20 0.43
▸ NOS2 P35228 1/20 0.43
▸ PARP14 Q460N5 4/20 0.43
▸ DYRK1A Q13627 2/20 0.42
▸ CDK5 Q00535 2/20 0.42
▸ CDK5R1 Q15078 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ GLA P06280 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ MAPT P10636 1/20 0.41

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
SCHEMBL17284922 0.84 TDO2 (0.50) ARTDO2NOS3NOS1NOS2
SCHEMBL19690758 0.79 AR (0.42) ARPIM1CSNK2A2CSNK2BPIM3
SCHEMBL7499024 0.78 ERCC5 (0.50) DYRK1ACDK5CDK5R1KDM4EALDH1A1
SCHEMBL24071853 0.78 AHR (0.45) TDO2PIM1CSNK2A2CSNK2BPIM3
SCHEMBL16482458 0.78 KDM4E (0.46) TDO2PIM1CSNK2A2CSNK2BPIM3
SCHEMBL29499026 0.78 AHR (0.45) TDO2PIM1CSNK2A2CSNK2BPIM3
SCHEMBL16482459 0.74 KIF11 (0.56) TDO2DYRK1ACDK5CDK5R1KDM4E
SCHEMBL19690761 0.74 AR (0.43) ARPIM1CSNK2A2CSNK2BPIM3
SCHEMBL1635623 0.73 KIF11 (0.50) TDO2PIM1PIM3PIM2DYRK1A
SCHEMBL28416978 0.73 KIF11 (0.50) TDO2PIM1PIM3PIM2DYRK1A

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-20150340625-A1 ORGANIC THIN FILM TRANSISTOR, ORGANIC SEMICONDUCTOR THIN FILM, AND ORGANIC SEMICONDUCTOR MATERIAL FUJIFILM CORPORATION (JP) 2015-11-26 — — 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-20150340625-A1 ORGANIC THIN FILM TRANSISTOR, ORGANIC SEMICONDUCTOR THIN FILM, AND ORGANIC SEMICONDUCTOR MATERIAL OR10J3, SLCO2A1, SLC43A1 AR 3505/4885TDO2 980/4885PIM1 2562/4885

“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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