SCHEMBL29935524

SCHEMBL29935524

Cc1cccnc1O[C@H]1CCN(c2ccc(Br)cc2C#N)C1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 1/20 0.41
▸ HCRTR1 O43613 6/20 0.41
▸ HCRTR2 O43614 6/20 0.41
▸ ACACB O00763 2/20 0.40
▸ FFAR4 Q5NUL3 1/20 0.39
▸ PDE10A Q9Y233 1/20 0.38
▸ GPR6 P46095 1/20 0.37

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
SCHEMBL26620359 1.00 RET (0.41) RETHCRTR1HCRTR2ACACBFFAR4
SCHEMBL23703064 1.00 RET (0.41) RETHCRTR1HCRTR2ACACBFFAR4
SCHEMBL23708132 0.88 ACACB (0.38) HCRTR1HCRTR2ACACBPDE10AGPR6
SCHEMBL29935823 0.88 ACACB (0.38) HCRTR1HCRTR2ACACBPDE10AGPR6
SCHEMBL23708279 0.88 ACACB (0.38) HCRTR1HCRTR2ACACBPDE10AGPR6
SCHEMBL23702776 0.88 ACACB (0.38) HCRTR1HCRTR2ACACBPDE10AGPR6
SCHEMBL29994814 0.86 EGLN1 (0.46) RETHCRTR1HCRTR2ACACBFFAR4
SCHEMBL23708179 0.86 EGLN1 (0.46) RETHCRTR1HCRTR2ACACBFFAR4
SCHEMBL26620459 0.86 EGLN1 (0.46) RETHCRTR1HCRTR2ACACBFFAR4
SCHEMBL23708261 0.84 HCRTR1 (0.42) HCRTR1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118702672-A Compounds and compositions for treating skin disorders 卡玛瑞制药有限公司 2024-09-27 — — CN disclosed
CN-115335050-B Compounds and compositions for treating skin disorders 卡玛瑞制药有限公司 2024-05-17 — — CN disclosed
EP-4096661-A1 COMPOUNDS AND COMPOSITIONS FOR USE IN TREATING SKIN DISORDERS Kamari Pharma Ltd. (IL) 2022-12-07 — — EP disclosed
CN-115335050-A Compounds and compositions for treating skin conditions 卡玛瑞制药有限公司 2022-11-11 — — CN disclosed
US-20220332697-A1 COMPOUNDS AND COMPOSITIONS FOR USE IN TREATING SKIN DISORDERS KAMARI PHARMA LTD. (IL) 2022-10-20 — — 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 (1 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-20220332697-A1 COMPOUNDS AND COMPOSITIONS FOR USE IN TREATING SKIN DISORDERS RDX, HAX1, F12 RET 2321/4885HCRTR1 894/4885HCRTR2 2355/4885

“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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