SCHEMBL23908720

SCHEMBL23908720

Oc1cc(Br)cc(N2CCCc3ccccc32)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
AVPR2 P30518 1/20 0.43
AVPR1A P37288 1/20 0.43
ALDH1A1 P00352 3/20 0.43
MAPT P10636 3/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
SIGMAR1 Q99720 1/20 0.42
NPC1 O15118 1/20 0.41
USP2 O75604 1/20 0.41
LMNA P02545 1/20 0.41
ALOX15 P16050 1/20 0.41
ROCK1 Q13464 1/20 0.41
HTT P42858 1/20 0.41
TUBB4A P04350 1/20 0.40
TUBB P07437 1/20 0.40
TUBA3C P0DPH7 1/20 0.40

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
SCHEMBL31410785 1.00 MEN1 (0.44) MEN1KMT2AAVPR2AVPR1AALDH1A1
SCHEMBL31410786 1.00 MEN1 (0.44) MEN1KMT2AAVPR2AVPR1AALDH1A1
SCHEMBL23908719 0.82 ROCK1 (0.43) MEN1KMT2AMAPTSMN1; SMN2SIGMAR1
SCHEMBL28159694 0.82 MAPT (0.52) MEN1KMT2AAVPR2AVPR1AALDH1A1
SCHEMBL28847051 0.81 MEN1 (0.53) MEN1KMT2AAVPR2AVPR1AALDH1A1
SCHEMBL23391380 0.80 TUBB4A (0.41) MEN1KMT2AMAPTSMN1; SMN2SIGMAR1
SCHEMBL23917423 0.79 SIGMAR1 (0.38) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL22975002 0.79 LMNA (0.39) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL30065653 0.79 LMNA (0.39) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL11601096 0.79 SMN1; SMN2 (0.49) MEN1KMT2AALDH1A1MAPTGAA

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-20210320254-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2021-10-14 US disclosed
CN-113493474-A Condensed-cyclic compound and organic light-emitting element including same 三星显示有限公司 2021-10-12 CN 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-20210320254-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME ORAI2, SLC39A11, SLC39A7 MEN1 225/4885KMT2A 1767/4885AVPR2 2802/4885

“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.