SCHEMBL6301457

SCHEMBL6301457

OCc1cc(F)c(Cl)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.37
KDM1A O60341 2/20 0.35
KDM1B Q8NB78 1/20 0.35
ALDH1A1 P00352 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
P2RX7 Q99572 2/20 0.33
ALPL P05186 4/20 0.33
HTR2A P28223 2/20 0.33
SLC6A4 P31645 1/20 0.33
KCNH2 Q12809 1/20 0.33
MAPT P10636 3/20 0.32
MAPK1 P28482 1/20 0.32
MEN1 O00255 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
CBFB Q13951 1/20 0.31
TSHR P16473 1/20 0.31
PLA2G1B P04054 1/20 0.31
CYP1A2 P05177 1/20 0.31

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
SCHEMBL6192193 0.91 GPR84 (0.37) GPR84KDM1AKDM1BALDH1A1TDP1
SCHEMBL3824032 0.88 POLB (0.33) GPR84KDM1AKDM1BALDH1A1MAPT
SCHEMBL30030883 0.86 KDM1A (0.39) GPR84KDM1AKDM1BALDH1A1TDP1
SCHEMBL376895 0.86 KDM1A (0.39) GPR84KDM1AKDM1BALDH1A1TDP1
SCHEMBL24133181 0.82 ALOX15 (0.39) ALDH1A1TDP1MAPTMEN1HTT
SCHEMBL14573871 0.81 GPR84 (0.37) GPR84KDM1AKDM1BALDH1A1TDP1
SCHEMBL30296468 0.80 KDM1A (0.44) KDM1AKDM1BKCNH2
SCHEMBL3367070 0.80 KDM1A (0.37) GPR84KDM1AKDM1BALDH1A1TDP1
SCHEMBL25584446 0.80 SHBG (0.34)
SCHEMBL2554312 0.80 KDM1A (0.44) KDM1AKDM1BKCNH2

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-10961231-B2 NTCP inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-03-30 US disclosed
US-20210040072-A1 NTCP Inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-02-11 US disclosed
CN-112218878-A NTCP inhibitors 北京生命科学研究所 2021-01-12 CN disclosed
US-20090182140-A1 Alicyclic Heterocyclic Compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-07-16 US disclosed
US-20090182140-A1 Alicyclic Heterocyclic Compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-07-16 US disclosed
EP-1970373-A1 ALICYCLIC HETEROCYCLIC COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2008-09-17 EP disclosed
US-6911469-B2 Sulfonamide compounds and pharmaceutical use thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-06-28 US disclosed
US-20040180947-A1 hypoglycemic activity or phoshodiesterase-V inhibitory activity; prophylaxis and treatment of impaired glucose tolerance disorder, diabetes (e.g., type II diabetes), diabetic complications FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-09-16 US disclosed
US-20020099212-A1 For therapy of disease treatable based on a blood sugar level-depressing activity or a disease treatable based on a cGMP-PDE inhibiting activity, smooth muscle relaxing activity, bronchodilating activity, vasodilating activity FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2002-07-25 US disclosed
US-6348474-B1 COMPOUNDS AS ANTIDIABETIC AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-02-19 US disclosed
EP-0995742-A1 SULFONAMIDE COMPOUNDS AND MEDICINAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-04-26 EP 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-20020099212-A1 For therapy of disease treatable based on a blood sugar level-depressing activity or a disease treatable based on a cGMP-PDE inhibiting activity, smooth muscle relaxing activity, bronchodilating activity, vasodilating activity PDE2A, PDE3A, PDE12 GPR84 609/4885KDM1A 459/4885KDM1B 335/4885
US-20090182140-A1 Alicyclic Heterocyclic Compound CCR4, CCR1, HRH4 GPR84 146/4885KDM1A 1097/4885KDM1B 652/4885
US-20210040072-A1 NTCP Inhibitors HAVCR2, NPC1, HMGCR GPR84 1036/4885KDM1A 2974/4885KDM1B 3786/4885
US-20040180947-A1 hypoglycemic activity or phoshodiesterase-V inhibitory activity; prophylaxis and treatment of impaired glucose tolerance disorder, diabetes (e.g., type II diabetes), diabetic complications PDE2A, PDE3A, PYGM GPR84 1821/4885KDM1A 722/4885KDM1B 587/4885
US-10961231-B2 NTCP inhibitors HAVCR2, NPC1, HMGCR GPR84 1036/4885KDM1A 2974/4885KDM1B 3786/4885

“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.