SCHEMBL19009724

SCHEMBL19009724

c1ccc(-c2nc3c4ccccc4c4ccccc4c3c3c2cc(-c2c4ccccc4c(-c4cccnc4)c4ccccc24)c2ccccc23)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 4/20 0.45
GPR84 Q9NQS5 1/20 0.39
CYP19A1 P11511 2/20 0.38
PIM1 P11309 1/20 0.36
PIM3 Q86V86 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
KDM4E B2RXH2 3/20 0.36
HTT P42858 2/20 0.36
DHODH Q02127 1/20 0.36
LMNA P02545 1/20 0.36
IDO1 P14902 1/20 0.35
LRRK2 Q5S007 1/20 0.35
CYP11B2 P19099 3/20 0.35
CYP2C9 P11712 3/20 0.35
CYP17A1 P05093 1/20 0.35
HPGD P15428 2/20 0.34
F2 P00734 1/20 0.34
ADORA2A P29274 1/20 0.34
ADORA1 P30542 1/20 0.34
CYP1A2 P05177 2/20 0.34

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
SCHEMBL17034965 0.85 CYP11B1 (0.43) CYP11B1GPR84CYP19A1DHODHLMNA
SCHEMBL18907219 0.85 CYP11B1 (0.42) CYP11B1GPR84CYP19A1PIM1PIM3
SCHEMBL19009701 0.84 CYP11B1 (0.43) CYP11B1GPR84CYP19A1PIM1PIM3
SCHEMBL18907207 0.82 KDM4E (0.44) CYP11B1GPR84CYP19A1KDM4EHTT
SCHEMBL19009727 0.81 ADORA2A (0.41) KDM4EHTTHPGDADORA2AADORA1
SCHEMBL19009766 0.81 ALDH1A1 (0.37) KDM4EDHODHCYP2C9HPGDCYP3A4
SCHEMBL18907300 0.81 ESR1 (0.44) CYP11B1GPR84CYP19A1KDM4EDHODH
SCHEMBL17035127 0.80 DHODH (0.43) CYP11B1GPR84CYP19A1HTTDHODH
SCHEMBL19009712 0.79 KDM4E (0.38) KDM4EDHODHLMNACYP2C9HPGD
SCHEMBL19020501 0.79 ADORA2A (0.37) KDM4EHTTADORA2AADORA1MEN1

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-20170179407-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-22 US disclosed
US-20170179407-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-22 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-20170179407-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNT1 CYP11B1 341/4885GPR84 2049/4885CYP19A1 65/4885

“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.