SCHEMBL34368

SCHEMBL34368

CN(SSN(C)c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
HTT P42858 1/20 0.46
FAAH O00519 1/20 0.44
PHGDH O43175 1/20 0.44
MGLL Q99685 1/20 0.44
ALDH1A1 P00352 5/20 0.40
CA12 O43570 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
MAPT P10636 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
TSHR P16473 3/20 0.39

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
SCHEMBL18378161 0.82 MEN1 (0.46) MEN1KMT2AHTTFAAHPHGDH
SCHEMBL18715283 0.78 MEN1 (0.42) MEN1KMT2AHTTFAAHPHGDH
SCHEMBL14046945 0.78 FAAH (0.46) MEN1KMT2AHTTFAAHPHGDH
SCHEMBL21087657 0.76 KMT2A (0.41) MEN1KMT2AHTTFAAHPHGDH
SCHEMBL19148797 0.76 KMT2A (0.41) MEN1KMT2AHTTFAAHPHGDH
SCHEMBL20842915 0.74 MEN1 (0.39) MEN1KMT2AHTTFAAHPHGDH
Hydrochloric Acid SCHEMBL6427969 0.73 ALDH1A1 (0.59) MEN1KMT2AHTTFAAHPHGDH
SCHEMBL16211966 0.72 MEN1 (0.38) MEN1KMT2AHTTFAAHPHGDH
SCHEMBL21087538 0.72 MEN1 (0.38) MEN1KMT2AHTTFAAHPHGDH
SCHEMBL20130857 0.72 MEN1 (0.38) MEN1KMT2AHTTFAAHPHGDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2281852-B1 PNEUMATIC TIRE COMPRISING A FILM COMPOSED OF A THERMOPLASTIC ELASTOMER COMPOSITION AS INNER LINER YOKOHAMA RUBBER CO LTD (JP) 2016-03-09 EP disclosed
US-8536271-B2 Thermoplastic elastomer composition THE YOKOHAMA RUBBER CO., LTD. (JP) 2013-09-17 US disclosed
EP-2281852-A1 Thermoplastic elastomer composition The Yokohama Rubber Company, Limited (JP) 2011-02-09 EP disclosed
US-20110028648-A1 THERMOPLASTIC ELASTOMER COMPOSITION THE YOKOHAMA RUBBER CO., LTD. (JP) 2011-02-03 US disclosed