SCHEMBL343793

SCHEMBL343793

CON(C)C(=O)C(C)(C)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.50
MAPT P10636 1/20 0.50
KCNN4 O15554 2/20 0.44
CES1 P23141 1/20 0.41
CYP2C19 P33261 2/20 0.40
OPRM1 P35372 2/20 0.40
DRD3 P35462 2/20 0.40
HIF1A Q16665 1/20 0.40
DRD4 P21917 1/20 0.40
ALDH1A1 P00352 2/20 0.39
ALOX15 P16050 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39

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
SCHEMBL5949668 0.84 MLYCD (0.41) KMT2AMAPTCES1ALDH1A1HDAC1
SCHEMBL3047658 0.82 KMT2A (0.50) KMT2AMAPTCYP2C19ALDH1A1MLYCD
SCHEMBL5642972 0.80 KMT2A (0.57) KMT2AMAPTKCNN4CYP2C19OPRM1
SCHEMBL31058184 0.77 MLYCD (0.36) KMT2AMAPTHDAC4HDAC6MLYCD
SCHEMBL8414824 0.77 MAPT (0.39) KMT2AMAPTKCNN4CES1CYP2C19
SCHEMBL9500920 0.77 KMT2A (0.53) KMT2AMAPTKCNN4CYP2C19OPRM1
SCHEMBL19553964 0.76 ALDH1A1 (0.43) KMT2AMAPTCYP2C19HIF1AALDH1A1
SCHEMBL19553778 0.76 LMNA (0.36) ALDH1A1MLYCDRAB9ASMN1; SMN2
SCHEMBL3676123 0.75 NPC1 (0.47) KMT2AMAPTALDH1A1MLYCDPOLB
SCHEMBL11032674 0.73 KMT2A (0.53) KMT2AMAPTKCNN4CYP2C19OPRM1

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113387797-B Preparation method of key intermediate of erlotinib 常州工程职业技术学院 2022-07-08 CN disclosed
US-10364240-B2 Aryl sulfonamides ChemoCentryx. Inc. (US) 2019-07-30 US disclosed
US-10364240-B2 Aryl sulfonamides ChemoCentryx. Inc. (US) 2019-07-30 US disclosed
US-9890148-B2 Aryl sulfonamides CHEMOCENTRYX, INC. (US) 2018-02-13 US disclosed
US-9890148-B2 Aryl sulfonamides CHEMOCENTRYX, INC. (US) 2018-02-13 US disclosed
US-20170369483-A1 ARYL SULFONAMIDES CHEMOCENTRYX, INC. (US) 2017-12-28 US disclosed
US-20150080351-A1 ARYL SULFONAMIDES CHEMOCENTRYX, INC. 2015-03-19 US disclosed
US-20150080351-A1 ARYL SULFONAMIDES CHEMOCENTRYX, INC. 2015-03-19 US disclosed
US-20150080351-A1 ARYL SULFONAMIDES CHEMOCENTRYX, INC. 2015-03-19 US disclosed
US-20130267492-A1 ARYL SULFONAMIDES CHEMOCENTRYX, INC. (US) 2013-10-10 US disclosed
US-20120014997-A1 ARYL SULFONAMIDES UNGASHE SOLOMON (US) 2012-01-19 US disclosed
US-20090163498-A1 Aryl Sulfonamides CHEMOCENTRYX, INC. (US) 2009-06-25 US disclosed
US-20090163498-A1 Aryl Sulfonamides CHEMOCENTRYX, INC. (US) 2009-06-25 US disclosed
US-20090163498-A1 Aryl Sulfonamides CHEMOCENTRYX, INC. (US) 2009-06-25 US disclosed
US-7420055-B2 Antagonists of the chemokine receptor 9 (CCR9); inhibit TECK ligand; antiinflammatory agents and immunoregulators; inflammatory bowel disease; (2-phenylsulfonamidophenyl)-pyridinyl-methanones; N-[4-chloro-2(pyridine4-carbonyl)-phenyl]4-morpholin-4-yl-benzenesulfonamide CHEMOCENTRYX, INC. (US) 2008-09-02 US disclosed
US-7420055-B2 Antagonists of the chemokine receptor 9 (CCR9); inhibit TECK ligand; antiinflammatory agents and immunoregulators; inflammatory bowel disease; (2-phenylsulfonamidophenyl)-pyridinyl-methanones; N-[4-chloro-2(pyridine4-carbonyl)-phenyl]4-morpholin-4-yl-benzenesulfonamide CHEMOCENTRYX, INC. (US) 2008-09-02 US disclosed
US-7420055-B2 Antagonists of the chemokine receptor 9 (CCR9); inhibit TECK ligand; antiinflammatory agents and immunoregulators; inflammatory bowel disease; (2-phenylsulfonamidophenyl)-pyridinyl-methanones; N-[4-chloro-2(pyridine4-carbonyl)-phenyl]4-morpholin-4-yl-benzenesulfonamide CHEMOCENTRYX, INC. (US) 2008-09-02 US disclosed
US-20060111351-A1 Aryl sulfonamides CHEMOCENTRYX, INC. 2006-05-25 US disclosed
WO-2005112925-A1 ARYL SULFONAMIDES CHEMOCENTRYX (US) 2005-12-01 WO disclosed
US-20050137193-A1 Aryl sulfonamides CHEMOCENTREYX 2005-06-23 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 (8 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-20050137193-A1 Aryl sulfonamides CCR9, CCR1, CCR2 KMT2A 2760/4885MAPT 4194/4885KCNN4 4667/4885
US-10364240-B2 Aryl sulfonamides CCR9, CCR1, CCR2 KMT2A 2760/4885MAPT 4194/4885KCNN4 4667/4885
US-20120014997-A1 ARYL SULFONAMIDES CCR9, CCR1, CCR2 KMT2A 2760/4885MAPT 4194/4885KCNN4 4667/4885
US-20060111351-A1 Aryl sulfonamides CCR9, CCR1, CCR2 KMT2A 2760/4885MAPT 4194/4885KCNN4 4667/4885
US-20170369483-A1 ARYL SULFONAMIDES CCR9, CCR1, CCR2 KMT2A 2760/4885MAPT 4194/4885KCNN4 4667/4885
US-20150080351-A1 ARYL SULFONAMIDES CCR9, CCR1, CCR2 KMT2A 2760/4885MAPT 4194/4885KCNN4 4667/4885
US-20090163498-A1 Aryl Sulfonamides CCR9, CCR1, CCR2 KMT2A 2760/4885MAPT 4194/4885KCNN4 4667/4885
US-20130267492-A1 ARYL SULFONAMIDES CCR9, CCR1, CCR2 KMT2A 2760/4885MAPT 4194/4885KCNN4 4667/4885

“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.