SCHEMBL30389049

SCHEMBL30389049

COC(=O)[C@H]1CC[C@@H](c2ccc(C(C)(C)C)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.56
▸ GAA P10253 1/20 0.42
▸ S1PR1 P21453 1/20 0.42
▸ RAB9A P51151 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ HPGD P15428 1/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ MAPT P10636 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ ALOX15 P16050 1/20 0.39
▸ APEX1 P27695 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL23605146 1.00 SLC6A2 (0.56) SLC6A2GAAS1PR1RAB9AALDH1A1
SCHEMBL30389265 1.00 SLC6A2 (0.56) SLC6A2GAAS1PR1RAB9AALDH1A1
SCHEMBL13008709 0.92 SLC6A2 (0.55) SLC6A2GAAS1PR1RAB9AALDH1A1
SCHEMBL13008767 0.86 SLC6A2 (0.54) SLC6A2GAAS1PR1RAB9AALDH1A1
SCHEMBL25141743 0.82 ESR2 (0.55) RAB9ANPC1CYP3A4
SCHEMBL12303028 0.82 ALDH1A1 (0.51) SLC6A2RAB9AALDH1A1NPC1
SCHEMBL30282867 0.82 ESR2 (0.55) RAB9ANPC1CYP3A4
SCHEMBL23574936 0.82 RAB9A (0.60) SLC6A2GAARAB9AALDH1A1HPGD
SCHEMBL23575248 0.82 RAB9A (0.60) SLC6A2GAARAB9AALDH1A1HPGD
SCHEMBL23574937 0.82 RAB9A (0.60) SLC6A2GAARAB9AALDH1A1HPGD

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
EP-3583096-B1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS RQX PHARMACEUTICALS INC (US) 2024-03-27 — — EP disclosed
US-20230133667-A1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS RQX PHARMACEUTICALS INC (US) 2023-05-04 — — 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 (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-20230133667-A1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS MRPL21, PEPD, CTSC SLC6A2 4847/4885GAA 978/4885S1PR1 3766/4885

“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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