SCHEMBL17904084

SCHEMBL17904084

Cn1c2ccc(-n3c4ccccc4c4ccccc43)cc2c2ccc(N(c3ccccc3)c3ccccc3)cc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.43
▸ GPR3 P46089 1/20 0.42
▸ MAPT P10636 5/20 0.41
▸ HPGD P15428 4/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ PABPC1 P11940 1/20 0.41
▸ KIF11 P52732 1/20 0.40
▸ ATM Q13315 2/20 0.40
▸ NPC1 O15118 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ RXRA P19793 1/20 0.37
▸ RXRB P28702 1/20 0.37
▸ TSHR P16473 1/20 0.35

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
SCHEMBL17904082 0.95 KDM4E (0.43) KDM4EGPR3MAPTHPGDALDH1A1
SCHEMBL15606658 0.95 KDM4E (0.44) KDM4EGPR3MAPTHPGDALDH1A1
SCHEMBL17904091 0.93 KDM4E (0.43) KDM4EGPR3MAPTHPGDALDH1A1
SCHEMBL11922012 0.89 RXRA (0.44) KDM4EGPR3MAPTHPGDALDH1A1
SCHEMBL10087108 0.88 KDM4E (0.51) KDM4EGPR3MAPTHPGDALDH1A1
SCHEMBL10087141 0.88 KDM4E (0.51) KDM4EGPR3MAPTHPGDALDH1A1
SCHEMBL15747046 0.87 GPR3 (0.55) KDM4EGPR3MAPTHPGDALDH1A1
SCHEMBL16773080 0.86 KDM4E (0.50) KDM4EMAPTHPGDALDH1A1HSD17B10
SCHEMBL17915767 0.86 KDM4E (0.44) KDM4EMAPTHPGDALDH1A1HSD17B10
SCHEMBL17915769 0.86 KDM4E (0.44) KDM4EMAPTHPGDALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10032991-B2 Compound, organic electroluminescence element material, ink composition, organic electroluminescence element, electronic device, and method for producing compound IDEMITSU KOSAN CO., LTD. (JP) 2018-07-24 — — US disclosed
US-20160197288-A1 COMPOUND, ORGANIC ELECTROLUMINESCENCE ELEMENT MATERIAL, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, ELECTRONIC DEVICE, AND METHOD FOR PRODUCING COMPOUND IDEMITSU KOSAN CO., LTD. (JP) 2016-07-07 — — US disclosed
US-9061060-B2 Deuterated benzylbenzene derivatives and methods of use THERACOS INC. (US) 2015-06-23 — — 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 (2 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-20160197288-A1 COMPOUND, ORGANIC ELECTROLUMINESCENCE ELEMENT MATERIAL, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, ELECTRONIC DEVICE, AND METHOD FOR PRODUCING COMPOUND LEF1, L1CAM, OLA1 KDM4E 2220/4885GPR3 4794/4885MAPT 2940/4885
US-10032991-B2 Compound, organic electroluminescence element material, ink composition, organic electroluminescence element, electronic device, and method for producing compound LEF1, L1CAM, OLA1 KDM4E 2220/4885GPR3 4794/4885MAPT 2940/4885

“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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