SCHEMBL21643099

SCHEMBL21643099

CC(C)c1noc(C2CCN(c3nc4ccc(Oc5ccc(C[SH](=O)=O)cc5)nc4s3)CC2)n1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 1/20 0.40
▸ CHRM4 P08173 1/20 0.36
▸ GPR119 Q8TDV5 9/20 0.36
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ ACACB O00763 7/20 0.34
▸ EPHX2 P34913 1/20 0.34
▸ CCR5 P51681 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33

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
SCHEMBL19454675 0.88 CNR2 (0.44) CNR2CHRM4GPR119CYP3A4CYP2C19
SCHEMBL29504590 0.85 GPR119 (0.49) CNR2GPR119CYP3A4CYP2C19
SCHEMBL19434765 0.85 GPR119 (0.49) CNR2GPR119CYP3A4CYP2C19
SCHEMBL21643090 0.79 GPR119 (0.46) GPR119ACACB
SCHEMBL29504628 0.77 CNR2 (0.50) CNR2CHRM4GPR119CYP3A4CYP2C19
SCHEMBL19434953 0.77 CNR2 (0.50) CNR2CHRM4GPR119CYP3A4CYP2C19
SCHEMBL20943620 0.75 CNR2 (0.39) CNR2CHRM4GPR119CYP3A4CYP2C19
SCHEMBL19454580 0.73 CNR2 (0.51) CNR2CHRM4GPR119CYP3A4CYP2C19
SCHEMBL19434851 0.73 CNR2 (0.46) CNR2CHRM4GPR119CYP3A4CYP2C19
SCHEMBL29504481 0.73 CNR2 (0.46) CNR2CHRM4GPR119CYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10919915-B2 Compounds as GPR119 agonists MANKIND PHARMA LTD. (IN) 2021-02-16 — — US disclosed
US-20200040006-A1 NOVEL COMPOUNDS AS GPR119 AGONISTS MANKIND PHARMA LTD. (IN) 2020-02-06 — — 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 (2 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-20200040006-A1 NOVEL COMPOUNDS AS GPR119 AGONISTS GPR119, GPR84, GPR65 CNR2 71/4885CHRM4 304/4885GPR119 1/4885
US-10919915-B2 Compounds as GPR119 agonists GPR119, GPR84, GPR65 CNR2 72/4885CHRM4 275/4885GPR119 1/4885

“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.

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