SCHEMBL7759160

SCHEMBL7759160

CC(C#N)=CC=C(C)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 1/20 0.38
▸ ALDH1A1 P00352 8/20 0.37
▸ MAPT P10636 5/20 0.37
▸ KMT2A Q03164 4/20 0.37
▸ MAPK1 P28482 3/20 0.37
▸ RAB9A P51151 3/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ LMNA P02545 1/20 0.36
▸ XBP1 P17861 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ CES2 O00748 1/20 0.34
▸ CES1 P23141 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ PDE4A P27815 1/20 0.34
▸ PDE4B Q07343 1/20 0.34
▸ PDE4C Q08493 1/20 0.34
▸ PDE4D Q08499 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34

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
SCHEMBL28691456 0.84 KMT2A (0.41) KDM1AALDH1A1MAPTKMT2AMAPK1
SCHEMBL2945263 0.84 PDE4A (0.41) ALDH1A1MAPTKMT2AMAPK1RAB9A
SCHEMBL2945266 0.84 PDE4A (0.41) ALDH1A1MAPTKMT2AMAPK1RAB9A
SCHEMBL23458237 0.82 KDM1A (0.48) KDM1AALDH1A1MAPTKMT2AMAPK1
SCHEMBL6900954 0.82 KDM1A (0.48) KDM1AALDH1A1MAPTKMT2AMAPK1
SCHEMBL23458124 0.82 KDM1A (0.48) KDM1AALDH1A1MAPTKMT2AMAPK1
SCHEMBL11206059 0.82 KDM1A (0.48) KDM1AALDH1A1MAPTKMT2AMAPK1
SCHEMBL24620122 0.82 GABRA1 (0.41) ALDH1A1MAPTKMT2AMAPK1RAB9A
SCHEMBL15596606 0.82 ESR1 (0.47) ALDH1A1MAPTKMT2AMAPK1MEN1
SCHEMBL23285690 0.82 PARP10 (0.50) ALDH1A1MAPTKMT2ARAB9AL3MBTL1

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-20160243728-A1 METHOD FOR PRODUCING THERMOPLASTIC MOLDING COMPOUNDS, AND THERMOPLASTIC MOLDING COMPOUNDS PRODUCED ACCORDING THERETO HSBC CORPORATE TRUSTEE COMPANY (UK) LIMITED (GB) 2016-08-25 — — US disclosed
EP-1080151-A1 POLYOXYMETHYLENE SHAPED BODIES BASF AKTIENGESELLSCHAFT (DE) 2001-03-07 — — EP disclosed
WO-1999050351-A1 POLYOXYMETHYLENE SHAPED BODIES BASF AKTIENGESELLSCHAFT (DE) 1999-10-07 — — WO disclosed
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