SCHEMBL18700271

SCHEMBL18700271

COCCn1c(C)ccc1-c1ccc(SC)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.50
ADORA3 P0DMS8 1/20 0.50
CHRM1 P11229 1/20 0.50
TBXA2R P21731 1/20 0.50
PTGS1 P23219 1/20 0.50
SLC6A2 P23975 1/20 0.50
PDE4A P27815 1/20 0.50
ADRA1A P35348 1/20 0.50
DRD3 P35462 1/20 0.50
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ALOX15 P16050 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
ALDH1A1 P00352 6/20 0.39
LMNA P02545 2/20 0.39
MAPT P10636 1/20 0.38
PIM1 P11309 1/20 0.36
CLK2 P49760 1/20 0.36
CLK4 Q9HAZ1 1/20 0.36
SLC6A4 P31645 2/20 0.35

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
SCHEMBL18888318 0.84 SLC6A2 (0.53) PGRADORA3CHRM1TBXA2RPTGS1
SCHEMBL18883308 0.83 PGR (0.47) PGRADORA3CHRM1TBXA2RPTGS1
SCHEMBL12471766 0.82 PGR (0.48) PGRADORA3CHRM1TBXA2RPTGS1
SCHEMBL16558089 0.81 PGR (0.49) PGRADORA3CHRM1TBXA2RPTGS1
SCHEMBL13633791 0.79 ADORA3 (0.44) PGRADORA3CHRM1TBXA2RPTGS1
SCHEMBL18413078 0.78 PGR (0.60) PGRADORA3CHRM1TBXA2RPTGS1
SCHEMBL17747396 0.78 PGR (0.44) PGRADORA3CHRM1TBXA2RPTGS1
SCHEMBL11488799 0.74 ALDH1A1 (0.48) MEN1KMT2AALOX15TDP1ALDH1A1
SCHEMBL14360472 0.73 MAPK13 (0.39) PGRADORA3CHRM1TBXA2RPTGS1
Ethyl Propionate SCHEMBL16347730 0.73 PGR (0.65) PGRADORA3CHRM1TBXA2RPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10385017-B2 Pyrrole compound, compositions and process for preparation thereof CADILA HEALTHCARE LIMITED (IN) 2019-08-20 US disclosed
US-10315993-B2 Synergistic compositions CADILA HEALTHCARE LIMITED (IN) 2019-06-11 US disclosed
US-9951009-B2 Polymorphic form of pyrrole derivative and intermediate thereof CADILA HEALTHCARE LIMITED (IN) 2018-04-24 US disclosed
US-20170144968-A1 PROCESS FOR PREPARATION OF PYRROLES HAVING HYPOLIPIDEMIC HYPOCHOLESTEREMIC ACTIVITIES ZYDUS LIFESCIENCES LIMITED (IN) 2017-05-25 US disclosed
US-9656954-B2 Synergistic compositions CADILA HEALTHCARE LIMITED (IN) 2017-05-23 US disclosed
US-9610277-B2 Formula comprising a hypolipidemic agent CADILA HEALTHCARE LIMITED (IN) 2017-04-04 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 (3 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-10315993-B2 Synergistic compositions DPP4, DPP7, PPARD PGR 1195/4885ADORA3 1902/4885CHRM1 2827/4885
US-20170144968-A1 PROCESS FOR PREPARATION OF PYRROLES HAVING HYPOLIPIDEMIC HYPOCHOLESTEREMIC ACTIVITIES CYP51A1, LIPA, DHCR7 PGR 3708/4885ADORA3 3898/4885CHRM1 4312/4885
US-10385017-B2 Pyrrole compound, compositions and process for preparation thereof GGPS1, TPMT, ADCYAP1R1 PGR 2659/4885ADORA3 3516/4885CHRM1 4810/4885

“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.