SCHEMBL18938962

SCHEMBL18938962

Clc1ccc(-c2ccc(N(c3ccc(-c4cccc5ccccc45)cc3)c3ccc(-c4cccc5ccccc45)cc3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 3/20 0.47
▸ CA1 P00915 3/20 0.47
▸ CA2 P00918 3/20 0.47
▸ CA9 Q16790 3/20 0.47
▸ HDAC8 Q9BY41 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ ENPP3 O14638 1/20 0.41
▸ ENPP1 P22413 1/20 0.41
▸ CYP1A2 P05177 4/20 0.41
▸ BMX P51813 1/20 0.40
▸ CRHR1 P34998 1/20 0.40
▸ CHRNB4 P30926 1/20 0.40
▸ CHRNA3 P32297 1/20 0.40
▸ CHRNA7 P36544 1/20 0.40
▸ PPARG P37231 5/20 0.39
▸ PPARA Q07869 5/20 0.39
▸ CYP2C19 P33261 2/20 0.38
▸ CYP1A1 P04798 1/20 0.38
▸ CYP1B1 Q16678 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38

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
SCHEMBL25740891 0.98 CA12 (0.45) CA12CA1CA2CA9HDAC8
SCHEMBL25098590 0.91 CA12 (0.54) CA12CA1CA2CA9HDAC8
SCHEMBL6374305 0.91 CA12 (0.54) CA12CA1CA2CA9HDAC8
SCHEMBL17550872 0.89 CA12 (0.51) CA12CA1CA2CA9HDAC8
SCHEMBL29597362 0.89 CA12 (0.56) CA12CA1CA2CA9HDAC8
SCHEMBL21905500 0.89 CA12 (0.56) CA12CA1CA2CA9HDAC8
SCHEMBL14270741 0.88 CA12 (0.51) CA12CA1CA2CA9HDAC8
SCHEMBL7593430 0.88 CA12 (0.51) CA12CA1CA2CA9HDAC8
SCHEMBL14188157 0.88 CA12 (0.51) CA12CA1CA2CA9HDAC8
SCHEMBL14490059 0.88 CA12 (0.51) CA12CA1CA2CA9HDAC8

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-10756277-B2 Organic compound and organic electroluminescent device comprising the same DOOSAN SOLUS CO., LTD. (KR) 2020-08-25 — — US disclosed
US-20170170406-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME DOOSAN CORPORATION (KR) 2017-06-15 — — 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-20170170406-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME OR10J3, ORC3, L1CAM CA12 1302/4885CA1 2335/4885CA2 1794/4885
US-10756277-B2 Organic compound and organic electroluminescent device comprising the same OR10J3, L1CAM, ICOSLG CA12 2032/4885CA1 3432/4885CA2 2740/4885

“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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