SCHEMBL13624088

SCHEMBL13624088

CCn1ncc2cc(C(C)(C)C)ccc21

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
NR3C1 P04150 1/20 0.40
KCNH2 Q12809 1/20 0.38
CYP11B1 P15538 2/20 0.37
CYP11B2 P19099 2/20 0.37
KMO O15229 1/20 0.36
CACNA1H O95180 3/20 0.35
GLS O94925 1/20 0.35
HASPIN Q8TF76 1/20 0.35
TMEM97 Q5BJF2 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
SLC5A2 P31639 1/20 0.34
TRPM8 Q7Z2W7 1/20 0.34
HTR1D P28221 1/20 0.34
PGR P06401 1/20 0.34
RORA P35398 1/20 0.34
RORC P51449 1/20 0.34
RORB Q92753 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
SCHEMBL26777096 0.85 HTR2A (0.39) HTR2AHTR2CNR3C1KCNH2CYP11B1
SCHEMBL26270853 0.81 HTR2A (0.52) HTR2AHTR2CNR3C1KCNH2CYP11B1
SCHEMBL4434459 0.81 KMO (0.42) KMOCACNA1HTRPM8
SCHEMBL13483882 0.80 KMO (0.38) HTR2AHTR2CNR3C1KCNH2CYP11B1
SCHEMBL26270865 0.80 HTR2A (0.51) HTR2AHTR2CNR3C1KCNH2CYP11B1
SCHEMBL13483881 0.80 MAOB (0.49) HTR2AHTR2CNR3C1KCNH2CYP11B1
SCHEMBL12938771 0.80 HDAC1 (0.43) HTR2AHTR2CNR3C1KCNH2CYP11B1
SCHEMBL21026002 0.78 MCHR1 (0.53) KCNH2
SCHEMBL7071662 0.77 KMO (0.45) HTR2AHTR2CNR3C1CYP11B1CYP11B2
SCHEMBL2627065 0.77 TRPA1 (0.47) NR3C1KCNH2CYP11B1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11661406-B2 Method for producing intermediate useful for synthesis of SGLT inhibitor DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2023-05-30 US disclosed
US-11661406-B2 Method for producing intermediate useful for synthesis of SGLT inhibitor DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2023-05-30 US disclosed
US-20210292291-A1 METHOD FOR PRODUCING INTERMEDIATE USEFUL FOR SYNTHESIS OF SGLT INHIBITOR DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2021-09-23 US disclosed
US-10889574-B2 Method for producing diphenylmethane derivative DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2021-01-12 US disclosed
US-10640496-B2 Method for producing diphenylmethane derivative DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2020-05-05 US disclosed
US-20190169174-A1 METHOD FOR PRODUCING DIPHENYLMETHANE DERIVATIVE DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2019-06-06 US disclosed
US-9371303-B2 Diphenylmethane derivatives as SGLT2 inhibitors GREEN CROSS CORPORATION (KR) 2016-06-21 US disclosed
US-20150152075-A1 NOVEL DIPHENYLMETHANE DERIVATIVES AS SGLT2 INHIBITORS GREEN CROSS CORPORATION (KR) 2015-06-04 US disclosed
US-9034921-B2 Diphenylmethane derivatives as SGLT2 inhibitors GREEN CROSS CORPORATION (KR) 2015-05-19 US disclosed
US-8921412-B2 C-aryl ansa SGLT2 inhibitors GREEN CROSS CORPORATION (KR) 2014-12-30 US disclosed
US-20140274918-A1 METHOD FOR DUAL INHIBITION OF SGLT1 AND SGLT2 USING DIPHENYLMETHANE DERIVATIVES GREEN CROSS CORPORATION (KR) 2014-09-18 US disclosed
US-20140213642-A1 NOVEL C-ARYL ANSA SGLT2 INHIBITORS GREEN CROSS CORPORATION (KR) 2014-07-31 US disclosed
US-20140088079-A1 NOVEL DIPHENYLMETHANE DERIVATIVES AS SGLT2 INHIBITORS GREEN CROSS CORPORATION (KR) 2014-03-27 US disclosed
US-20090291945-A1 CYSTEINE PROTEASE INHIBITORS TEIJIN PHARMA LIMITED (JP) 2009-11-26 US disclosed
US-7622491-B2 Type 2 diabetes, atherosclerosis, cardiovascular disease, Syndrome X; carboxylic acids with dialkyldiether or thioether linking groups e.g. {4-[3-(2-Benzotriazol-2-yl-4-chloro-phenoxy)-propoxy]-phenyl}-acetic acid and {4-[3-(2-benzotriazol-2-yl-4-thiophen-2-yl-phenoxy)-propoxy]-phenyl}-acetic acid METABOLEX INC. (US) 2009-11-24 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 (10 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-20190169174-A1 METHOD FOR PRODUCING DIPHENYLMETHANE DERIVATIVE SLC5A2, SLC5A1, SLC2A1 HTR2A 587/4885HTR2C 512/4885NR3C1 1957/4885
US-20140088079-A1 NOVEL DIPHENYLMETHANE DERIVATIVES AS SGLT2 INHIBITORS SLC5A2, SLC5A1, SLC2A8 HTR2A 973/4885HTR2C 938/4885NR3C1 1305/4885
US-20210292291-A1 METHOD FOR PRODUCING INTERMEDIATE USEFUL FOR SYNTHESIS OF SGLT INHIBITOR SLC5A2, SLC5A1, UGT2B7 HTR2A 979/4885HTR2C 461/4885NR3C1 818/4885
US-20090291945-A1 CYSTEINE PROTEASE INHIBITORS CTSE, SPINT2, CTSF HTR2A 4692/4885HTR2C 4579/4885NR3C1 2043/4885
US-11661406-B2 Method for producing intermediate useful for synthesis of SGLT inhibitor SLC5A2, SLC5A1, UGT2B7 HTR2A 979/4885HTR2C 461/4885NR3C1 818/4885
US-20140213642-A1 NOVEL C-ARYL ANSA SGLT2 INHIBITORS SLC5A2, SLC5A1, SLC2A1 HTR2A 895/4885HTR2C 1393/4885NR3C1 1561/4885
US-10640496-B2 Method for producing diphenylmethane derivative SLC5A2, SLC5A1, SLC2A1 HTR2A 587/4885HTR2C 512/4885NR3C1 1957/4885
US-10889574-B2 Method for producing diphenylmethane derivative SLC5A2, SLC5A1, SLC2A1 HTR2A 587/4885HTR2C 512/4885NR3C1 1957/4885
US-20150152075-A1 NOVEL DIPHENYLMETHANE DERIVATIVES AS SGLT2 INHIBITORS SLC5A2, SLC5A1, SLC2A8 HTR2A 938/4885HTR2C 898/4885NR3C1 1117/4885
US-20140274918-A1 METHOD FOR DUAL INHIBITION OF SGLT1 AND SGLT2 USING DIPHENYLMETHANE DERIVATIVES SLC5A2, SLC5A1, SLC10A2 HTR2A 942/4885HTR2C 1130/4885NR3C1 515/4885

“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.