SCHEMBL31064938

SCHEMBL31064938

Clc1cccc([Si](Cl)(Cl)c2ccccc2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
TP53 P04637 1/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 1/20 0.39
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
SCN2A Q99250 1/20 0.37
IDO1 P14902 1/20 0.37
ADORA2A P29274 2/20 0.36
ADORA1 P30542 2/20 0.36
PNMT P11086 1/20 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
SCHEMBL17966510 0.93 TSHR (0.44) TSHRNPC1RAB9ATP53NFKB1
SCHEMBL31465211 0.93 TSHR (0.44) TSHRNPC1RAB9ATP53NFKB1
SCHEMBL76000 0.80 TSHR (0.39) TSHRNPC1RAB9AALDH1A1LMNA
SCHEMBL29120692 0.80 TSHR (0.39) TSHRNPC1RAB9AALDH1A1LMNA
Benzene SCHEMBL28183259 0.80 TSHR (0.39) TSHRNPC1RAB9AALDH1A1LMNA
SCHEMBL25183167 0.79 TSHR (0.46) TSHRNPC1RAB9ATP53NFKB1
SCHEMBL2335006 0.78 TSHR (0.44) TSHRNPC1RAB9ATP53NFKB1
SCHEMBL17966523 0.78 TSHR (0.44) TSHRNPC1RAB9ATP53NFKB1
SCHEMBL20829729 0.78 TSHR (0.50) TSHRNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL25271319 0.77 MAOA (0.43) RAB9ASMN1; SMN2ALDH1A1MEN1KMT2A

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-12219868-B2 Organic electroluminescence device SAMSUNG DISPLAY CO., LTD. (KR) 2025-02-04 US disclosed
US-20240315127-A1 ORGANIC COMPOUND, LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2024-09-19 US disclosed
CN-118580260-A Organic compound, light-emitting device, electronic apparatus, and electronic device 三星显示有限公司 2024-09-03 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 (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-20240315127-A1 ORGANIC COMPOUND, LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE RPL31, RPL38, RNF31 TSHR 3501/4885NPC1 2926/4885RAB9A 2384/4885
US-12219868-B2 Organic electroluminescence device ODC1, LEF1, OR10J3 TSHR 4713/4885NPC1 1104/4885RAB9A 2226/4885

“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.