SCHEMBL9307793

SCHEMBL9307793

CCCCCCCCN(CCCCCCCC)S(=O)(=O)c1ccccc1C

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
TP53 P04637 1/20 0.47
TSHR P16473 2/20 0.44
HCRTR2 O43614 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
PTPN1 P18031 1/20 0.42
SERPINE1 P05121 1/20 0.42
CNR2 P34972 3/20 0.42
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
MAPK1 P28482 1/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
MCHR1 Q99705 1/20 0.41
VCAM1 P19320 1/20 0.41
GLA P06280 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
SCHEMBL5507153 0.95 CA12 (0.47) ALDH1A1TP53TSHRHCRTR2TDP1
SCHEMBL3693999 0.93 TSHR (0.49) ALDH1A1TSHRHCRTR2TDP1PTPN1
SCHEMBL5505271 0.90 CA12 (0.48) ALDH1A1TSHRHCRTR2TDP1PTPN1
SCHEMBL2583710 0.87 TSHR (0.57) ALDH1A1TP53TSHRHCRTR2TDP1
SCHEMBL6843428 0.85 HDAC3 (0.47) ALDH1A1TP53HCRTR2CA9
SCHEMBL28278188 0.83 TDP1 (0.41) ALDH1A1TP53HCRTR2TDP1SERPINE1
SCHEMBL9683547 0.81 SMN1; SMN2 (0.46) ALDH1A1TP53HCRTR2PTPN1CA12
SCHEMBL9308951 0.81 TSHR (0.50) ALDH1A1TSHRTDP1CA12CA9
SCHEMBL8915849 0.80 TSHR (0.50) ALDH1A1TSHRTDP1CNR2CA9
SCHEMBL8527676 0.80 KMT2A (0.47) ALDH1A1TP53TSHRHCRTR2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200131335-A1 SURFACE ACTIVE ADJUVANT RHODIA OPERATIONS (FR) 2020-04-30 US disclosed
EP-3612604-A1 SURFACE ACTIVE ADJUVANT Rhodia Operations (FR) 2020-02-26 EP disclosed
WO-2020035124-A1 SURFACE ACTIVE ADJUVANT FOR COATINGS RHODIA OPERATIONS (FR) 2020-02-20 WO disclosed
CN-110536936-A Surface-active adjuvant RHODIA OPERATIONS 2019-12-03 CN disclosed
WO-2018193009-A1 SURFACE ACTIVE ADJUVANT RHODIA OPERATIONS (FR) 2018-10-25 WO disclosed
US-5328884-A Salicylic acid salt,and amide or sulfonamide as developer KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1994-07-12 US disclosed
US-5250108-A Mixture of salicylic acid salt, amide and sulfonamide compounds KANZAKI PAPER MANUFACTURING CO. LTD. (JP) 1993-10-05 US disclosed