SCHEMBL17875776

SCHEMBL17875776

c1cncc(-c2cc(-c3cccnc3)cc(-c3ccc4c(c3)-c3cc(-n5c6ccccc6c6ccccc65)ccc3CSC4)c2)c1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 13/20 0.40
CYP11B1 P15538 11/20 0.40
TDP2 O95551 2/20 0.39
CYP1A2 P05177 4/20 0.37
CYP19A1 P11511 4/20 0.36
CYP17A1 P05093 3/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
PIM1 P11309 1/20 0.36
PIM3 Q86V86 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
DRD2 P14416 2/20 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
SCHEMBL17875719 0.96 CYP11B2 (0.38) CYP11B2CYP11B1TDP2CYP1A2CYP19A1
SCHEMBL17875752 0.96 CYP11B2 (0.41) CYP11B2CYP11B1TDP2CYP1A2CYP19A1
SCHEMBL17877733 0.90 CYP11B2 (0.42) CYP11B2CYP11B1CYP1A2CYP19A1CYP17A1
SCHEMBL17875884 0.88 CYP11B1 (0.40) CYP11B2CYP11B1TDP2CYP1A2CYP19A1
SCHEMBL17875812 0.88 KDM4E (0.33) PIM1PIM3DRD2
SCHEMBL17875805 0.87 KDM4E (0.39) TDP2
SCHEMBL17877726 0.86 CYP11B2 (0.41) CYP11B2CYP11B1TDP2CYP1A2CYP19A1
SCHEMBL17875731 0.86 FLT3 (0.41) CYP11B2CYP11B1CYP1A2CYP19A1CYP17A1
SCHEMBL17875985 0.85 TDP2 (0.40) CYP11B2CYP11B1TDP2CYP1A2CYP19A1
SCHEMBL17876288 0.85 PIM1 (0.39) CYP11B2CYP11B1TDP2CYP1A2CYP19A1

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-10581000-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-03-03 US disclosed
US-20160190482-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-06-30 US disclosed
US-20160190482-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-06-30 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-10581000-B2 Condensed cyclic compound and organic light-emitting device including the same CRY1, CRY2, CCNE2 CYP11B2 1374/4885CYP11B1 938/4885TDP2 3979/4885
US-20160190482-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNE2 CYP11B2 1374/4885CYP11B1 938/4885TDP2 3979/4885

“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.