SCHEMBL20230738

SCHEMBL20230738

CC1(C)c2cc(Br)ccc2Oc2ccc(-c3cc(-c4cccnc4)nc(-c4cccnc4)c3)cc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.48
CYP11B2 P19099 2/20 0.48
CYP19A1 P11511 3/20 0.48
BACE1 P56817 4/20 0.47
KDM4E B2RXH2 3/20 0.41
KMT2A Q03164 3/20 0.41
RXFP1 Q9HBX9 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
PRNP P04156 1/20 0.40
PPARG P37231 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NR2E3 Q9Y5X4 1/20 0.40
NCOR2 Q9Y618 1/20 0.40
CTSD P07339 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
MEN1 O00255 2/20 0.38
MAPT P10636 2/20 0.38
KCNH2 Q12809 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
SCHEMBL20230702 0.81 CYP19A1 (0.45) CYP11B1CYP11B2CYP19A1BACE1CTSD
SCHEMBL20230739 0.80 CYP19A1 (0.44) CYP11B1CYP11B2CYP19A1BACE1CTSD
SCHEMBL14679633 0.77 CYP11B1 (0.57) CYP11B1CYP11B2CYP19A1KDM4ETDP1
SCHEMBL30019882 0.77 CYP11B1 (0.57) CYP11B1CYP11B2CYP19A1KDM4ETDP1
SCHEMBL16158816 0.77 KMT2A (0.44) CYP19A1BACE1KDM4EKMT2ATDP1
SCHEMBL16158662 0.77 KMT2A (0.44) CYP19A1BACE1KDM4EKMT2ATDP1
SCHEMBL14849905 0.77 CYP19A1 (0.74) CYP11B1CYP11B2CYP19A1KDM4EKMT2A
SCHEMBL16158715 0.76 KMT2A (0.40) CYP19A1BACE1KDM4EKMT2ATDP1
SCHEMBL20230743 0.75 NR1H4 (0.40) BACE1KDM4EKMT2AALDH1A1LMNA
SCHEMBL21510275 0.74 CYP19A1 (0.45) CYP11B1CYP11B2CYP19A1BACE1CTSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180159050-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2018-06-07 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-20180159050-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CCNE2, CCNT1 CYP11B1 1257/4885CYP11B2 1681/4885CYP19A1 305/4885

“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.