SCHEMBL16407768

SCHEMBL16407768

C=C(/C=C\C=C/N)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RECQL P46063 3/20 0.38
▸ BLM P54132 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ TSHR P16473 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ PARP1 P09874 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ PMP22 Q01453 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ MAOB P27338 3/20 0.35
▸ MAOA P21397 2/20 0.35
▸ AKT1 P31749 1/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ F2 P00734 1/20 0.33
▸ F10 P00742 1/20 0.33
▸ F12 P00748 1/20 0.33

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
SCHEMBL26782059 1.00 RECQL (0.38) RECQLBLMMAPTTDP1TSHR
SCHEMBL17548813 0.85 MAOB (0.39) RECQLBLMMAPTTDP1TSHR
SCHEMBL13084075 0.80 — —
SCHEMBL18381166 0.79 MEN1 (0.38) RECQLBLMMAPTTDP1TSHR
SCHEMBL2089662 0.79 AKT1 (0.39) RECQLBLMMAPTTDP1TSHR
SCHEMBL14997435 0.79 AKT1 (0.39) RECQLBLMMAPTTDP1TSHR
SCHEMBL2089663 0.79 AKT1 (0.39) RECQLBLMMAPTTDP1TSHR
SCHEMBL27886109 0.79 AKT1 (0.39) RECQLBLMMAPTTDP1TSHR
SCHEMBL11269634 0.78 AKT1 (0.41) RECQLBLMMAPTTDP1TSHR
SCHEMBL2553036 0.78 AKT1 (0.41) RECQLBLMMAPTTDP1TSHR

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
EP-3174115-A1 CHARGE TRANSPORT MATERIAL Nissan Chemical Industries, Ltd. (JP) 2017-05-31 — — EP disclosed
US-9553274-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2017-01-24 — — US disclosed
US-20150021556-A1 BICARBAZOLE CONTAINING COMPOUNDS UNIVERSAL DISPLAY CORPORATION (US) 2015-01-22 — — US disclosed
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