SCHEMBL18564828

SCHEMBL18564828

Cn1c2cc(N(c3ccccc3)c3ccc(-c4ccccc4)cc3)ccc2c2c3ccccc3ccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 1/20 0.37
▸ RXRA P19793 1/20 0.36
▸ RXRB P28702 1/20 0.36
▸ NQO2 P16083 1/20 0.34
▸ CDK4 P11802 1/20 0.34
▸ CCND1 P24385 1/20 0.34
▸ KMT2A Q03164 1/20 0.33
▸ PTGES O14684 1/20 0.33
▸ LIMK1 P53667 1/20 0.33
▸ TOP2A P11388 1/20 0.32
▸ RAB9A P51151 3/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ CASP1 P29466 1/20 0.32
▸ CASP7 P55210 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ HIF1A Q16665 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32

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
SCHEMBL18564929 0.95 MAOB (0.36) MAOBRXRARXRBNQO2CDK4
SCHEMBL18564867 0.95 MAOB (0.42) MAOBRXRARXRBNQO2CDK4
SCHEMBL18564776 0.95 MAOB (0.42) MAOBRXRARXRBNQO2CDK4
SCHEMBL18564817 0.95 NQO2 (0.37) NQO2TOP2ARAB9ACYP3A4HPGD
SCHEMBL18564891 0.94 MAOB (0.40) MAOBRXRARXRBNQO2CDK4
SCHEMBL18564892 0.94 MAOB (0.40) MAOBRXRARXRBNQO2CDK4
SCHEMBL18564749 0.94 RXRA (0.41) MAOBRXRARXRBNQO2CDK4
SCHEMBL18564747 0.94 RXRA (0.41) MAOBRXRARXRBNQO2CDK4
SCHEMBL18565009 0.92 RXRA (0.39) MAOBRXRARXRBNQO2PTGES
SCHEMBL18565011 0.92 RXRA (0.39) MAOBRXRARXRBNQO2PTGES

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-10290815-B2 Composition, compound, material for organic electroluminescence element, ink composition, organic electroluminescence element, and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2019-05-14 — — US disclosed
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-03-02 — — US disclosed
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-03-02 — — 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-10290815-B2 Composition, compound, material for organic electroluminescence element, ink composition, organic electroluminescence element, and electronic device EED, BMI1, CD99 MAOB 760/4885RXRA 4249/4885RXRB 4487/4885
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE EED, BMI1, CD99 MAOB 760/4885RXRA 4249/4885RXRB 4487/4885

“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.

Send feedback