SCHEMBL22740645

SCHEMBL22740645

CCn1c2ccccc2c2cccc(N(c3ccccc3)c3ccc4cc5c(cc4c3)oc3c5ccc4c5cc6ccc(N(c7ccccc7)c7cccc8c9ccccc9n(CC)c78)cc6cc5oc43)c21

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ KDM1A O60341 1/20 0.32
▸ PER2 O15055 1/20 0.32
▸ CRY1 Q16526 1/20 0.32
▸ CRY2 Q49AN0 1/20 0.32
▸ PGR P06401 1/20 0.31
▸ HPGD P15428 2/20 0.31
▸ MAPK1 P28482 2/20 0.31
▸ HTT P42858 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HBB P68871 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ LMNA P02545 1/20 0.30

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
SCHEMBL22742619 0.94 CYP1A2 (0.34) CYP1A2CYP3A4CYP2C19KDM1A
SCHEMBL22741235 0.92 PER2 (0.33) CYP1A2CYP3A4CYP2C19KDM1APER2
SCHEMBL22740728 0.89 CYP1A2 (0.33) CYP1A2CYP3A4CYP2C19KDM1APER2
SCHEMBL22742797 0.89 CYP1A2 (0.34) CYP1A2CYP3A4CYP2C19KDM1APER2
SCHEMBL22742800 0.87 KDM1A (0.39) CYP1A2CYP3A4CYP2C19KDM1APER2
SCHEMBL22742799 0.86 KDM4E (0.41) KDM1AHPGDMAPK1HTTKDM4E
SCHEMBL22742755 0.85 KDM4E (0.33) KDM4E
SCHEMBL22740460 0.83 CYP1A2 (0.34) CYP1A2CYP3A4CYP2C19KDM1A
SCHEMBL22740351 0.81 KDM1A (0.41) CYP1A2CYP3A4CYP2C19KDM1APER2
SCHEMBL22740495 0.80 SIGMAR1 (0.33) CYP1A2CYP3A4CYP2C19HPGDMAPK1

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-20200377513-A1 NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2020-12-03 — — 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-20200377513-A1 NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE PIEZO1, TMEM109, LEF1 CYP1A2 1206/4885CYP3A4 793/4885CYP2C19 183/4885

“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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