SCHEMBL20005352

SCHEMBL20005352

c1ccc(Nc2cccc(-c3cc4ccccc4c4ccccc34)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
MAPT P10636 5/20 0.50
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
AR P10275 1/20 0.50
CYP11B1 P15538 1/20 0.47
HPGD P15428 5/20 0.47
HSD17B10 Q99714 5/20 0.47
CYP3A4 P08684 3/20 0.47
TSHR P16473 4/20 0.46
CDC25B P30305 3/20 0.46
ALOX15 P16050 2/20 0.46
TP53 P04637 1/20 0.46
ATM Q13315 1/20 0.46
KDM4E B2RXH2 4/20 0.43
MPI P34949 1/20 0.43
TDP1 Q9NUW8 3/20 0.43
GAA P10253 2/20 0.43
LMNA P02545 1/20 0.43
GFER P55789 1/20 0.43

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
SCHEMBL23471905 0.96 CYP11B1 (0.50) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL26021689 0.95 ALDH1A1 (0.47) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL31016201 0.95 ALDH1A1 (0.47) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL31033498 0.95 ALDH1A1 (0.47) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL23626451 0.95 ALDH1A1 (0.47) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL26155243 0.95 EPHX2 (0.47) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL23471706 0.93 CYP11B1 (0.45) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL24889838 0.91 ALDH1A1 (0.46) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL26021884 0.91 ALDH1A1 (0.46) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL24955987 0.90 CYP11B1 (0.45) ALDH1A1MAPTMEN1KMT2AAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118510755-A Compound and organic light emitting device comprising the same 株式会社LG化学 2024-08-16 CN disclosed
WO-2023075158-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-05-04 WO disclosed
CN-112552275-B Spiro compound and application thereof 上海钥熠电子科技有限公司 2022-11-01 CN disclosed
CN-112552275-A Spiro compound and application thereof 上海钥熠电子科技有限公司 2021-03-26 CN disclosed
US-20180090687-A1 CROSS-CONJUGATED POLYMER, MATERIAL FOR ELECTRONIC ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD (JP) 2018-03-29 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-20180090687-A1 CROSS-CONJUGATED POLYMER, MATERIAL FOR ELECTRONIC ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT SLC18A1, SLC1A2, SLC43A1 ALDH1A1 764/4885MAPT 843/4885MEN1 4059/4885

“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.