SCHEMBL4808577

SCHEMBL4808577

CS(=O)(=O)Nc1cccnc1Cl

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 3/20 0.60
HTT P42858 3/20 0.60
ALOX15 P16050 1/20 0.60
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
PIK3CA P42336 5/20 0.53
PIK3CD O00329 4/20 0.53
PIK3CB P42338 4/20 0.53
PIK3CG P48736 4/20 0.53
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
PTGS1 P23219 1/20 0.48
PTGS2 P35354 1/20 0.48
CKS1B P61024 2/20 0.47
SKP2 Q13309 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
KEAP1 Q14145 2/20 0.46
NFE2L2 Q16236 1/20 0.46
POLB P06746 1/20 0.45
NPC1 O15118 3/20 0.45

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
SCHEMBL4074257 0.81 GLO1 (0.64) GLO1HTTALOX15MEN1KMT2A
SCHEMBL8283225 0.81 KMT2A (0.52) GLO1HTTALOX15MEN1KMT2A
SCHEMBL27183247 0.80 KMT2A (0.59) GLO1HTTALOX15MEN1KMT2A
SCHEMBL27863537 0.79 GLO1 (0.62) GLO1HTTALOX15KMT2APIK3CA
SCHEMBL2084095 0.79 GLO1 (0.57) GLO1HTTALOX15KMT2APTGS1
SCHEMBL2307574 0.78 GLO1 (0.60) GLO1HTTALOX15KMT2APTGS1
SCHEMBL11335563 0.77 MEN1 (0.52) HTTMEN1KMT2ACYP2C9CYP2C19
SCHEMBL28946370 0.77 MEN1 (0.83) GLO1MEN1KMT2APIK3CAPIK3CD
SCHEMBL20851459 0.76 GLO1 (0.58) GLO1HTTALOX15PTGS1PTGS2
SCHEMBL8415758 0.76 POLB (0.48) HTTMEN1KMT2ASMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7351828-B2 Benzimidazoles that are useful in treating sexual dysfunction ABBOTT LABORATORIES (US) 2008-04-01 US disclosed
EP-1373220-B1 BENZIMIDAZOLES THAT ARE USEFUL IN TREATING SEXUAL DYSFUNCTION ABBOTT LAB (US) 2007-05-30 EP disclosed
US-7022728-B2 Benzimidazoles that are useful in treating male sexual dysfunction ABBOTT LABORATORIES (US) 2006-04-04 US disclosed
US-6960589-B2 Benzimidazoles that are useful in treating sexual dysfunction ABBOTT LABORATORIES (US) 2005-11-01 US disclosed
US-20040127504-A1 Benzimidazoles that are useful in treating sexual dysfunction ABBOTT LABORATORIES 2004-07-01 US disclosed
US-20040110766-A1 Benzimidazoles that are useful in treating sexual dysfunction ABBVIE INC. 2004-06-10 US disclosed
US-20030162790-A1 Benzimidazoles that are useful in treating sexual dysfunction ABBVIE INC. 2003-08-28 US disclosed
US-20020169167-A1 Benzimidazoles that are useful in treating sexual dysfunction ABBVIE INC. 2002-11-14 US disclosed
US-20020169166-A1 Benzimidazoles that are useful in treating sexual dysfunction ABBOTT LABORATORIES 2002-11-14 US disclosed
EP-0690848-A1 PIPERAZINYLPYRIDINYL WATER CLATHRATES PHARMACIA & UPJOHN COMPANY (US) 1996-01-10 EP disclosed
WO-1994022836-A2 PIPERAZINYLPYRIDINYL WATER CLATHRATES THE UPJOHN COMPANY (US) 1994-10-13 WO 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 (5 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-20020169167-A1 Benzimidazoles that are useful in treating sexual dysfunction CYP19A1, CYP51A1, CYP17A1 GLO1 902/4885HTT 4825/4885ALOX15 1181/4885
US-20040127504-A1 Benzimidazoles that are useful in treating sexual dysfunction CYP19A1, CYP51A1, CYP17A1 GLO1 902/4885HTT 4825/4885ALOX15 1181/4885
US-20020169166-A1 Benzimidazoles that are useful in treating sexual dysfunction CYP19A1, CYP51A1, CYP17A1 GLO1 902/4885HTT 4825/4885ALOX15 1181/4885
US-20030162790-A1 Benzimidazoles that are useful in treating sexual dysfunction CYP19A1, CYP51A1, CYP17A1 GLO1 902/4885HTT 4825/4885ALOX15 1181/4885
US-20040110766-A1 Benzimidazoles that are useful in treating sexual dysfunction CYP19A1, CYP51A1, CYP17A1 GLO1 902/4885HTT 4825/4885ALOX15 1181/4885

“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.