SCHEMBL11554272

SCHEMBL11554272

CS(=O)(=O)Oc1ccccn1.[NaH]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.40
LMNA P02545 3/20 0.39
KDM4E B2RXH2 3/20 0.39
POLB P06746 2/20 0.39
CCR1 P32246 2/20 0.39
CCR5 P51681 2/20 0.39
CCR8 P51685 2/20 0.39
CYP1A2 P05177 1/20 0.39
METAP1 P53582 1/20 0.39
BLM P54132 1/20 0.39
HIF1A Q16665 1/20 0.39
DOHH Q9BU89 1/20 0.39
P4HTM Q9NXG6 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
TSHR P16473 2/20 0.37
ATM Q13315 1/20 0.37
ALDH1A1 P00352 2/20 0.37
GRM5 P41594 1/20 0.36
NAAA Q02083 1/20 0.36
TP53 P04637 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
SCHEMBL1360826 0.98 LMNA (0.41) PTGS2LMNAKDM4EPOLBCCR1
SCHEMBL6512183 0.81 KDM4E (0.44) PTGS2LMNAKDM4EPOLBCCR1
SCHEMBL29049962 0.78 ALDH1A1 (0.39) PTGS2LMNAKDM4EPOLBCCR1
SCHEMBL1407984 0.78 KDM4E (0.41) PTGS2LMNAKDM4EPOLBCCR1
SCHEMBL6220452 0.78 TDP1 (0.43) PTGS2LMNAKDM4EPOLBCCR1
SCHEMBL3857735 0.78 LMNA (0.41) PTGS2LMNAKDM4EPOLBCCR1
SCHEMBL28752448 0.77 KDM4E (0.42) PTGS2LMNAKDM4EPOLBCCR1
SCHEMBL15362240 0.77 TSHR (0.46) PTGS2LMNAKDM4EPOLBCCR1
SCHEMBL23611463 0.76 KDM4E (0.39) PTGS2LMNAKDM4EPOLBCCR1
SCHEMBL3338098 0.76 ALDH1A1 (0.41) PTGS2LMNAKDM4ETDP1TSHR

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
US-4150232-A NICKEL ELECTROPLATING BATH BRIGHTENER ADDITIVES CILAG-CHEMIE A.G. (CH) 1979-04-17 US disclosed
US-4148797-A LEVELING AND BRIGHTENING AGENT FOR NICKEL ELECTROPLATING BATHS CILAG-CHEMIE A.G. (CH) 1979-04-10 US disclosed
US-4120859-A (N-Substituted-pyridyl)-alkyl sulfonic acid betaines as electroplating additives CILAG-CHEMIE A.G. (CH) 1978-10-17 US disclosed
US-4067785-A PYRIDYL ALKYL SULFONIC ACID BETAINES CILAG-CHEMIE A.G. (CH) 1978-01-10 US disclosed