SCHEMBL24091355

SCHEMBL24091355

CC(C)(C)OC(=O)N1C[C@@H]2CN(c3cc(C#N)nc(Cl)n3)[C@@H]2C1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 11/20 0.50
▸ USP30 Q70CQ3 1/20 0.40
▸ NR1H2 P55055 1/20 0.36
▸ KCNK3 O14649 1/20 0.35
▸ KCNK9 Q9NPC2 1/20 0.35
▸ NSD2 O96028 2/20 0.34
▸ HCRTR1 O43613 1/20 0.34
▸ HCRTR2 O43614 1/20 0.34
▸ EHMT2 Q96KQ7 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
SCHEMBL24091398 0.86 GPR119 (0.58) GPR119NR1H2KCNK3KCNK9NSD2
SCHEMBL24091357 0.84 GPR119 (0.50) GPR119
SCHEMBL24091518 0.81 GPR119 (0.56) GPR119NSD2EHMT2
SCHEMBL24091449 0.80 GPR119 (0.48) GPR119NSD2EHMT2
SCHEMBL24091482 0.79 GPR119 (0.56) GPR119NR1H2NSD2EHMT2
SCHEMBL24091570 0.79 GPR119 (0.47) GPR119USP30NR1H2NSD2EHMT2
SCHEMBL24091571 0.78 GPR119 (0.64) GPR119NR1H2
SCHEMBL24091447 0.78 GPR119 (0.46) GPR119USP30NR1H2NSD2EHMT2
SCHEMBL24091409 0.78 GPR119 (0.44) GPR119
SCHEMBL24091543 0.77 GPR119 (0.51) GPR119NSD2EHMT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230212164-A1 ANNULATED 2-AMINO-3-CYANO THIOPHENES AND DERIVATIVES FOR THE TREATMENT OF CANCER BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2023-07-06 — — US disclosed
US-20230212164-A1 ANNULATED 2-AMINO-3-CYANO THIOPHENES AND DERIVATIVES FOR THE TREATMENT OF CANCER BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2023-07-06 — — US disclosed
US-20210380574-A1 ANNULATED 2-AMINO-3-CYANO THIOPHENES AND DERIVATIVES FOR THE TREATMENT OF CANCER VANDERBILT UNIVERSITY 2021-12-09 — — 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-20230212164-A1 ANNULATED 2-AMINO-3-CYANO THIOPHENES AND DERIVATIVES FOR THE TREATMENT OF CANCER RSU1, KRAS, NRAS GPR119 3231/4885USP30 2363/4885NR1H2 4626/4885
US-20210380574-A1 ANNULATED 2-AMINO-3-CYANO THIOPHENES AND DERIVATIVES FOR THE TREATMENT OF CANCER RSU1, KRAS, NRAS GPR119 3666/4885USP30 2397/4885NR1H2 4740/4885

“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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