SCHEMBL23054258

SCHEMBL23054258

O=C(CN1CC(C(=O)O)C1)OCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ S1PR5 Q9H228 9/20 0.57
▸ S1PR1 P21453 5/20 0.54
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ NPC1 O15118 1/20 0.54
▸ RAB9A P51151 1/20 0.54
▸ ALDH1A1 P00352 5/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ PRKX P51817 1/20 0.49
▸ ACVR1 Q04771 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ CYP2C19 P33261 2/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ SLC6A2 P23975 1/20 0.44
▸ SLC6A3 Q01959 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL23734315 0.88 ALDH1A1 (0.50) S1PR5S1PR1SMN1; SMN2NPC1RAB9A
SCHEMBL19465324 0.86 NPC1 (0.53) SMN1; SMN2NPC1RAB9AALDH1A1L3MBTL1
SCHEMBL19966271 0.86 ALDH1A1 (0.53) SMN1; SMN2NPC1RAB9AALDH1A1MAPK1
SCHEMBL19557165 0.86 LTA4H (0.46) S1PR5SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL20981267 0.85 SMN1; SMN2 (0.66) SMN1; SMN2NPC1RAB9AALDH1A1MAPK1
SCHEMBL10859364 0.84 ALDH1A1 (0.61) SMN1; SMN2NPC1RAB9AALDH1A1MAPK1
SCHEMBL19604406 0.84 ALDH1A1 (0.50) SMN1; SMN2NPC1RAB9AALDH1A1MAPK1
SCHEMBL24970558 0.84 ALDH1A1 (0.50) S1PR5SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL19934909 0.84 FUCA1 (0.55) SMN1; SMN2NPC1RAB9AALDH1A1MAPK1
SCHEMBL19778180 0.83 HPGD (0.44) S1PR5SMN1; SMN2NPC1RAB9AALDH1A1

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-20230340011-A1 STEROIDAL COMPOSITIONS AND METHODS OF TREATING LIPOGENIC CANCERS Asteroid Therapeutics 2023-10-26 — — US disclosed
US-20210060168-A1 ASIALOGLYCOPROTEIN RECEPTOR MEDIATED DELIVERY OF THERAPEUTICALLY ACTIVE CONJUGATES ARCTURUS THERAPEUTICS, INC. 2021-03-04 — — 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 (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-20230340011-A1 STEROIDAL COMPOSITIONS AND METHODS OF TREATING LIPOGENIC CANCERS SREBF1, SREBF2, NR1H3 S1PR5 372/4885S1PR1 302/4885SMN1; SMN2 4785/4885
US-20210060168-A1 ASIALOGLYCOPROTEIN RECEPTOR MEDIATED DELIVERY OF THERAPEUTICALLY ACTIVE CONJUGATES ASGR1, FCGR2A, FCGR3B S1PR5 323/4885S1PR1 198/4885SMN1; SMN2 3266/4885

“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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