SCHEMBL4910639

SCHEMBL4910639

Cc1ccc(-c2cncc(-c3ccc(C)cc3)n2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.59
CYP11B2 P19099 2/20 0.59
METAP2 P50579 1/20 0.48
METAP1 P53582 1/20 0.48
ENPP3 O14638 1/20 0.47
ENPP1 P22413 1/20 0.47
KDM4E B2RXH2 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
KMT2A Q03164 5/20 0.45
MEN1 O00255 4/20 0.45
ALDH1A1 P00352 2/20 0.45
MITF O75030 1/20 0.45
KDM5A P29375 1/20 0.45
KDM5C P41229 1/20 0.45
PAX8 Q06710 1/20 0.45
CHEK1 O14757 2/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 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
SCHEMBL13264053 0.91 MEN1 (0.56) CYP11B1CYP11B2KDM4ESMN1; SMN2NPC1
SCHEMBL18850044 0.89 CYP11B1 (0.50) CYP11B1CYP11B2METAP2METAP1ENPP3
SCHEMBL15460383 0.86 CYP11B2 (0.56) CYP11B1CYP11B2METAP2METAP1ENPP3
SCHEMBL4901225 0.85 CYP11B2 (0.49) CYP11B1CYP11B2METAP2METAP1ENPP3
SCHEMBL5647023 0.85 CYP11B1 (0.47) CYP11B1CYP11B2METAP2METAP1ENPP3
SCHEMBL11518482 0.85 CYP11B1 (0.47) CYP11B1CYP11B2METAP2METAP1ENPP3
SCHEMBL19309835 0.84 CYP11B2 (0.55) CYP11B1CYP11B2METAP2ENPP3KDM4E
SCHEMBL4905901 0.79 TDP1 (0.62) CYP11B1CYP11B2KDM4ESMN1; SMN2NPC1
SCHEMBL31301361 0.79 SCN10A (0.51) CYP11B1CYP11B2SMN1; SMN2ALDH1A1CHEK1
SCHEMBL4907728 0.78 PIM1 (0.46) CYP11B1CYP11B2ENPP3ENPP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9040718-B2 Hybrid host materials for electrophosphorescent devices THE UNIVERSITY OF ROCHESTER (US) 2015-05-26 US disclosed
US-9040718-B2 Hybrid host materials for electrophosphorescent devices THE UNIVERSITY OF ROCHESTER (US) 2015-05-26 US disclosed
US-20100184942-A1 Hybrid Host Materials For Electrophosphorescent Devices THE UNIVERSITY OF ROCHESTER 2010-07-22 US disclosed
US-20080132698-A1 Use of N-oxide compounds in coupling reactions UNIVERSITY OF OTTAWA 2008-06-05 US disclosed
US-20080132698-A1 Use of N-oxide compounds in coupling reactions UNIVERSITY OF OTTAWA 2008-06-05 US disclosed
US-20080132698-A1 Use of N-oxide compounds in coupling reactions UNIVERSITY OF OTTAWA 2008-06-05 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-20080132698-A1 Use of N-oxide compounds in coupling reactions CYP4X1, CYP4F3, CYP1A2 CYP11B1 18/4885CYP11B2 6/4885METAP2 4179/4885
US-20100184942-A1 Hybrid Host Materials For Electrophosphorescent Devices SLC29A2, SLC43A3, SLC29A1 CYP11B1 4014/4885CYP11B2 3759/4885METAP2 1596/4885

“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.