SCHEMBL19130529

SCHEMBL19130529

c1ccc(-c2cc(-c3cccnc3)nc(-c3cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c3)n2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 2/20 0.54
▸ DHODH Q02127 1/20 0.49
▸ KDM4E B2RXH2 4/20 0.46
▸ LMNA P02545 3/20 0.46
▸ HTT P42858 1/20 0.46
▸ ALDH1A1 P00352 4/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ MAPT P10636 2/20 0.45
▸ HPGD P15428 1/20 0.45
▸ CYP2C9 P11712 4/20 0.44
▸ CYP11B1 P15538 1/20 0.44
▸ CYP1A2 P05177 3/20 0.44
▸ CYP3A4 P08684 3/20 0.44
▸ CLK4 Q9HAZ1 3/20 0.44
▸ CYP2D6 P10635 2/20 0.44
▸ TSHR P16473 2/20 0.44
▸ GLA P06280 2/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44

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
SCHEMBL22227773 0.97 CYP19A1 (0.55) CYP19A1DHODHKDM4ELMNAHTT
SCHEMBL17013980 0.96 DHODH (0.55) CYP19A1DHODHKDM4ELMNAHTT
SCHEMBL19130302 0.96 CYP19A1 (0.51) CYP19A1DHODHKDM4ELMNAHTT
SCHEMBL17369026 0.94 DHODH (0.53) CYP19A1DHODHKDM4ELMNAHTT
SCHEMBL17013859 0.94 DHODH (0.53) CYP19A1DHODHKDM4ELMNAHTT
SCHEMBL24252236 0.94 DHODH (0.53) CYP19A1DHODHKDM4ELMNAHTT
SCHEMBL17013880 0.94 KMO (0.48) CYP19A1DHODHKDM4ELMNAHTT
SCHEMBL17014032 0.94 KMO (0.48) CYP19A1DHODHKDM4ELMNAHTT
SCHEMBL17014037 0.94 CYP19A1 (0.51) CYP19A1DHODHKDM4ELMNAHTT
SCHEMBL17013981 0.94 CYP19A1 (0.51) CYP19A1DHODHKDM4ELMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170207395-A1 ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO., LTD. (JP) 2017-07-20 — — US disclosed
US-20170207395-A1 ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO., LTD. (JP) 2017-07-20 — — 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-20170207395-A1 ORGANIC ELECTROLUMINESCENT DEVICE KCNN2, SLC7A5, KCNH3 CYP19A1 638/4885DHODH 1526/4885KDM4E 689/4885

“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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