SCHEMBL28030199

SCHEMBL28030199

N#Cc1c(Cc2ccc(N)cc2)cccc1Cc1ccc(N)cc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.48
ALDH1A1 P00352 1/20 0.48
TSHR P16473 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
LOXL2 Q9Y4K0 2/20 0.41
HTR6 P50406 2/20 0.41
GFER P55789 1/20 0.38
MAOB P27338 4/20 0.38
MAOA P21397 2/20 0.38
CYP19A1 P11511 2/20 0.37
HTR2A P28223 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CYP17A1 P05093 1/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
MDM4 O15151 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
SCHEMBL28030201 0.81 MAOB (0.44) CYP3A4MAOBMAOACYP19A1CYP11B1
SCHEMBL7020464 0.79 TSHR (0.46) CYP3A4ALDH1A1TSHRTDP1HTR6
SCHEMBL486603 0.77 CYP3A4 (0.65) CYP3A4ALDH1A1TSHRTDP1LOXL2
SCHEMBL10564000 0.76 ALDH1A1 (0.46) CYP3A4ALDH1A1TSHRTDP1LOXL2
SCHEMBL10828333 0.74 BCL2 (0.41) ALDH1A1TSHRHTR2A
SCHEMBL21533699 0.74 ALDH1A1 (0.54) CYP3A4ALDH1A1TSHRTDP1LOXL2
SCHEMBL26552683 0.73 LOXL2 (0.47) ALDH1A1TSHRLOXL2MAOBMAOA
SCHEMBL8644538 0.73 KDM4E (0.37) ALDH1A1TSHRTDP1L3MBTL1
SCHEMBL10610547 0.72 CYP3A4 (0.52) CYP3A4ALDH1A1TSHRTDP1LOXL2
4,4'-Methylenedianiline SCHEMBL21001806 0.72 CYP3A4 (0.74) CYP3A4ALDH1A1TSHRTDP1LOXL2

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
CN-104927072-B A kind of Kapton and preparation method thereof of solvent resistant low thermal coefficient of expansion 六安市杜尔邦绝缘材料有限公司 2019-05-14 CN claimed
CN-104927072-A Solvent-resistant polyimide thin film with low thermal expansion coefficient and preparation method for polyimide thin film LU AN CITY DUERBANG INSULATION MATERIALS CO LTD 2015-09-23 CN claimed
CN-104927072-B A kind of Kapton and preparation method thereof of solvent resistant low thermal coefficient of expansion 六安市杜尔邦绝缘材料有限公司 2019-05-14 CN disclosed
CN-104927072-A Solvent-resistant polyimide thin film with low thermal expansion coefficient and preparation method for polyimide thin film LU AN CITY DUERBANG INSULATION MATERIALS CO LTD 2015-09-23 CN disclosed