SCHEMBL28104834

SCHEMBL28104834

O=P(OCc1ccccc1)(c1ccccc1)c1ccccc1.[Ir]

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.59
▸ MEN1 O00255 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ CETP P11597 3/20 0.45
▸ PDPK1 O15530 1/20 0.44
▸ MTOR P42345 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ CA2 P00918 2/20 0.43
▸ CA4 P22748 1/20 0.43
▸ CA5A P35218 1/20 0.43
▸ SRC P12931 1/20 0.41
▸ IDO1 P14902 1/20 0.41
▸ ELANE P08246 2/20 0.41
▸ ALPG P10696 1/20 0.41
▸ PTK2B Q14289 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ AGXT P21549 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
SCHEMBL389123 0.98 TSHR (0.61) TSHRMEN1KMT2ACETPPDPK1
SCHEMBL28519668 0.87 TSHR (0.50) TSHRMEN1KMT2ACETPPDPK1
SCHEMBL27956676 0.87 MEN1 (0.51) TSHRMEN1KMT2ACETPALDH1A1
SCHEMBL28449328 0.85 KMT2A (0.49) TSHRMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL28519236 0.85 MEN1 (0.49) TSHRMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL28453734 0.85 KMT2A (0.49) TSHRMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL28454755 0.85 MEN1 (0.53) TSHRMEN1KMT2ACETPALDH1A1
SCHEMBL28897993 0.85 APP (0.50) TSHRMEN1KMT2ACETPALDH1A1
SCHEMBL28520294 0.84 RAB9A (0.52) TSHRMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL28960451 0.82 MEN1 (0.50) TSHRMEN1KMT2ACETPPDPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108884016-B Arylamine derivatives and use thereof 日产化学株式会社 2022-11-01 — — CN disclosed
CN-106463636-B Charge-transporting varnish 日产化学工业株式会社 2020-04-03 — — CN disclosed
CN-106575709-B Charge-transporting material 日产化学工业株式会社 2020-01-07 — — CN disclosed
CN-106132923-B Oligoaniline derivative, charge-transporting varnish and organic electroluminescent device 日产化学工业株式会社 2019-11-15 — — CN disclosed
CN-106030843-B Charge-transporting varnish 日产化学工业株式会社 2019-01-18 — — CN disclosed
CN-106132917-B Triarylamine derivatives and its utilization 日产化学工业株式会社 2019-01-08 — — CN disclosed
CN-108884016-A Arylamine derivatives and use thereof 日产化学株式会社 2018-11-23 — — CN disclosed
CN-106575709-A charge-transporting material 日产化学工业株式会社 2017-04-19 — — CN disclosed
CN-106537629-A Charge-transporting varnish 日产化学工业株式会社 2017-03-22 — — CN disclosed
CN-106132917-A Triarylamine derivatives and utilization thereof 日产化学工业株式会社 2016-11-16 — — CN disclosed
CN-106132923-A Oligoaniline derivant, charge-transporting varnish and organic electroluminescent device 日产化学工业株式会社 2016-11-16 — — CN disclosed
CN-106030843-A Charge-transporting varnish 日产化学工业株式会社 2016-10-12 — — CN disclosed
Send feedback