SCHEMBL2010954

SCHEMBL2010954

O/N=C\c1c(Cl)cccc1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.55
SLC22A1 O15245 1/20 0.55
HTR1A P08908 1/20 0.55
ADRA2A P08913 1/20 0.55
CHRM1 P11229 1/20 0.55
ADRA2B P18089 1/20 0.55
ADRA2C P18825 1/20 0.55
MAOA P21397 1/20 0.55
DRD1 P21728 1/20 0.55
TBXA2R P21731 1/20 0.55
SLC6A2 P23975 1/20 0.55
ADRA1D P25100 1/20 0.55
HTR2A P28223 1/20 0.55
HTR2C P28335 1/20 0.55
SLC6A4 P31645 1/20 0.55
ADRA1A P35348 1/20 0.55
OPRM1 P35372 1/20 0.55
DRD3 P35462 1/20 0.55
HTR2B P41595 1/20 0.55
MTOR P42345 1/20 0.55

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
SCHEMBL533868 1.00 SMN1; SMN2 (0.55) SMN1; SMN2SLC22A1HTR1AADRA2ACHRM1
SCHEMBL533867 1.00 SMN1; SMN2 (0.55) SMN1; SMN2SLC22A1HTR1AADRA2ACHRM1
SCHEMBL6824608 0.87 TSHR (0.46) SMN1; SMN2SLC22A1HTR1AADRA2ACHRM1
SCHEMBL6824604 0.87 TSHR (0.46) SMN1; SMN2SLC22A1HTR1AADRA2ACHRM1
SCHEMBL2164318 0.85 CYP1A2 (0.54) SMN1; SMN2MEN1KMT2AALDH1A1TDP1
SCHEMBL29385007 0.85 CYP1A2 (0.54) SMN1; SMN2MEN1KMT2AALDH1A1TDP1
SCHEMBL2164321 0.85 CYP1A2 (0.54) SMN1; SMN2MEN1KMT2AALDH1A1TDP1
SCHEMBL19900104 0.85 NPSR1 (0.55) SMN1; SMN2SLC22A1HTR1AADRA2ACHRM1
SCHEMBL21195765 0.85 NPSR1 (0.55) SMN1; SMN2SLC22A1HTR1AADRA2ACHRM1
SCHEMBL5302952 0.85 CYP1A2 (0.54) SMN1; SMN2MEN1KMT2AALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023137135-A1 SOLID FORMS OF A BENZTHIAZOLE-PIPERAZINYL-OXAZOLE COMPOUND AND METHODS OF USE THEREOF Hepagene Therapeutics (HK) Limited (CN) 2023-07-20 WO disclosed
US-11339153-B2 Compounds useful in modulating the farnesoid X receptor and methods of making and using the same INORBIT THERAPEUTICS AB (SE) 2022-05-24 US disclosed
EP-3833434-B1 COMPOUNDS USEFUL IN MODULATING THE FARNESOID X RECEPTOR AND METHODS OF MAKING AND USING THE SAME INORBIT THERAPEUTICS AB (SE) 2021-12-15 EP disclosed
CN-113582807-A Method for synthesizing 2, 6-dichlorobenzyl chloride 江苏超跃化学有限公司 2021-11-02 CN disclosed
US-20210309656-A1 COMPOUNDS USEFUL IN MODULATING THE FARNESOID X RECEPTOR AND METHODS OF MAKING AND USING THE SAME INORBIT THERAPEUTICS AB (SE) 2021-10-07 US disclosed
EP-3529247-B1 HETEROCYCLIC FXR MODULATORS HEPAGENE THERAPEUTICS HK LTD (HK) 2021-08-18 EP disclosed
WO-2020033382-A1 COMPOUNDS USEFUL IN MODULATING THE FARNESOID X RECEPTOR AND METHODS OF MAKING AND USING THE SAME INORBIT THERAPEUTICS AB (SE) 2020-02-13 WO disclosed
EP-3202766-B1 ISOXAZOLE DERIVATIVE AS MUTATED ISOCITRATE DEHYDROGENASE 1 INHIBITOR DAIICHI SANKYO CO LTD (JP) 2019-12-25 EP disclosed
US-20190248752-A1 HETEROCYCLIC FXR MODULATORS Hepagene Therapeutics (HK) Limited (HK) 2019-08-15 US disclosed
US-10040791-B2 Isoxazole derivative as mutant isocitrate dehydrogenase 1 inhibitor DAIICHI SANKYO COMPANY, LIMITED (JP) 2018-08-07 US disclosed
US-6124469-A Process for preparing sulphurous 2-chloro-3-(4,5-dihydroisoxazol-3-yl)-benzoic acids BASF AKTIENGESELLSCHAFT (DE) 2000-09-26 US disclosed
EP-0966452-A1 PROCESS FOR PREPARING SULPHUROUS 2-CHLORO-3-(4,5-DIHYDROISOXAZOL-3-YL)-BENZOIC ACIDS BASF AKTIENGESELLSCHAFT (DE) 1999-12-29 EP disclosed
WO-1998031676-A1 PROCESS FOR PREPARING SULPHUROUS 2-CHLORO-3-(4,5-DIHYDROISOXAZOL-3-YL)-BENZOIC ACIDS BASF AKTIENGESELLSCHAFT (DE) 1998-07-23 WO disclosed
US-4910221-A Having a halogen group in position 4 of ring BAYER AKTIENGESELLSCHAFT (DE) 1990-03-20 US disclosed
US-4859235-A Pesticidal α-methylsulphonyl-benzaldoximes and carbamates thereof BAYER AKTIENGESELLSCHAFT (DE) 1989-08-22 US disclosed
EP-0286964-A2 Alpha-methyl-sulfonyl-benzadoxime carbamate BAYER AG (DE) 1988-10-19 EP disclosed
EP-0258391-A1 USE OF HETEROCYCLIC NITROGEN-CONTAINING COMPOUNDS FOR REDUCING MOISTURE LOSS FROM PLANTS AND INCREASING CROP YIELD RHONE POULENC NEDERLAND B.V. (NL) 1988-03-09 EP disclosed
WO-1987004321-A2 USE OF HETEROCYCLIC NITROGEN-CONTAINING COMPOUNDS FOR REDUCING MOISTURE LOSS FROM PLANTS AND INCREASING CROP YIELD RHONE-POULENC NEDERLANDS B.V. (NL) 1987-07-30 WO disclosed
EP-0208110-A1 Fungicidal agent based on a benzaldoxime derivative BAYER AG (DE) 1987-01-14 EP disclosed
US-4283403-A Substituted isoxazolines for control of plant phytopathogens ELI LILLY AND COMPANY (US) 1981-08-11 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 (4 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-20190248752-A1 HETEROCYCLIC FXR MODULATORS NR1H4, FXR1, NR1H2 SMN1; SMN2 4879/4885SLC22A1 1678/4885HTR1A 1834/4885
US-11339153-B2 Compounds useful in modulating the farnesoid X receptor and methods of making and using the same NR1H4, SLC10A2, FXR2 SMN1; SMN2 3384/4885SLC22A1 193/4885HTR1A 3512/4885
US-10040791-B2 Isoxazole derivative as mutant isocitrate dehydrogenase 1 inhibitor IDH1, IDH3A, IDH3B SMN1; SMN2 2777/4885SLC22A1 1585/4885HTR1A 3533/4885
US-20210309656-A1 COMPOUNDS USEFUL IN MODULATING THE FARNESOID X RECEPTOR AND METHODS OF MAKING AND USING THE SAME NR1H4, FXR1, FXR2 SMN1; SMN2 4870/4885SLC22A1 1605/4885HTR1A 2868/4885

“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.