SCHEMBL4371350

SCHEMBL4371350

NC(=O)c1ccc(F)cc1Cl.O=S(=O)(O)c1ccc(N2CCCCCC2)nc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 3/20 0.44
GAA P10253 2/20 0.44
HSD17B10 Q99714 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAPT P10636 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
OPRM1 P35372 1/20 0.43
OPRK1 P41145 1/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
HPGD P15428 1/20 0.43
HTT P42858 1/20 0.43
JAK2 O60674 2/20 0.42
BTK Q06187 1/20 0.41
KCNH2 Q12809 1/20 0.41
CNR2 P34972 3/20 0.41
CNR1 P21554 1/20 0.41
MEN1 O00255 1/20 0.40
PKM P14618 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
SCHEMBL4368487 0.99 KMT2A (0.46) KMT2AALDH1A1GAAHSD17B10L3MBTL1
SCHEMBL4374084 0.90 CNR2 (0.43) KMT2AALDH1A1GAAHSD17B10L3MBTL1
SCHEMBL4373567 0.90 ALDH1A1 (0.51) ALDH1A1GAAHSD17B10MAPTSMN1; SMN2
SCHEMBL1887570 0.90 RPS6KB1 (0.45) KMT2AMAPTSMN1; SMN2OPRM1OPRK1
SCHEMBL4371258 0.89 KMT2A (0.49) KMT2AALDH1A1GAAHSD17B10L3MBTL1
SCHEMBL4370293 0.88 KMT2A (0.47) KMT2AALDH1A1GAAHSD17B10L3MBTL1
SCHEMBL1881316 0.88 KDM4E (0.52) KMT2AALDH1A1GAAHSD17B10L3MBTL1
SCHEMBL1879254 0.88 KMT2A (0.45) KMT2AALDH1A1L3MBTL1SMN1; SMN2KDM4E
SCHEMBL4370142 0.88 KMT2A (0.45) KMT2AALDH1A1MAPTCA12CA1
SCHEMBL4371409 0.87 CA12 (0.43) KMT2AALDH1A1GAAMAPTSMN1; SMN2

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-7625896-B2 Pyridylsulfonamide derivatives HOFFMAN-LA ROCHE INC. (US) 2009-12-01 US claimed
US-20070123513-A1 6-thiomorpholin-4-yl-pyridine-3-sulfonic acid 4-chloro-2-methoxy-benzoylamide; ammonium salt of3-methyl-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-5'-sulfonic acid 4-chloro-2-methoxy-benzoylamide; anticarcinogenic agent HOFFMANN-LA ROCHE INC. 2007-05-31 US claimed
US-7625896-B2 Pyridylsulfonamide derivatives HOFFMAN-LA ROCHE INC. (US) 2009-12-01 US disclosed
US-20070123513-A1 6-thiomorpholin-4-yl-pyridine-3-sulfonic acid 4-chloro-2-methoxy-benzoylamide; ammonium salt of3-methyl-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-5'-sulfonic acid 4-chloro-2-methoxy-benzoylamide; anticarcinogenic agent HOFFMANN-LA ROCHE INC. 2007-05-31 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070123513-A1 6-thiomorpholin-4-yl-pyridine-3-sulfonic acid 4-chloro-2-methoxy-benzoylamide; ammonium salt of3-methyl-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-5'-sulfonic acid 4-chloro-2-methoxy-benzoylamide; anticarcinogenic agent TPMT, BPNT1, SLC6A3 KMT2A 959/4885ALDH1A1 1180/4885GAA 3480/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.