SCHEMBL15837679

SCHEMBL15837679

Cc1ccc(C2=NOC3(CCN(C(=O)CCC(F)(F)F)CC3)C2)cc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.43
ALDH1A1 P00352 2/20 0.43
LMNA P02545 1/20 0.43
KDM4E B2RXH2 1/20 0.40
KMT2A Q03164 1/20 0.39
ORAI1 Q96D31 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL17300438 0.93 ALDH1A1 (0.42) NPC1ALDH1A1LMNAKDM4EKMT2A
SCHEMBL22417572 0.92 ALDH1A1 (0.41) NPC1ALDH1A1LMNAKDM4EKMT2A
SCHEMBL15837767 0.90 NPC1 (0.44) NPC1ALDH1A1RAB9A
SCHEMBL15837685 0.90 NPC1 (0.42) NPC1LMNARAB9ASMN1; SMN2
SCHEMBL15837770 0.89 PSEN1 (0.46) NPC1ALDH1A1KDM4E
SCHEMBL15837704 0.89 EPHX2 (0.44) NPC1
SCHEMBL15837678 0.89 NPC1 (0.53) NPC1
SCHEMBL15837687 0.89 ALDH1A1 (0.43) NPC1ALDH1A1LMNAKDM4EKMT2A
SCHEMBL15837683 0.89 NPC1 (0.41) NPC1ALDH1A1KDM4E
SCHEMBL17300444 0.88 PSEN1 (0.42) NPC1KMT2A

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
EP-2935281-B1 SPIROISOXAZOLINE COMPOUNDS HAVING AN ACTIVITY POTENTIATING THE ACTIVITY OF AN ANTIBIOTIC UNIVERSITÉ DE DROIT ET DE LA SANTÉ DE LILLE 2 (FR) 2020-09-09 EP disclosed
US-10174050-B2 Spiroisoxazoline compounds having an activity potentiating the activity of an antibiotic UNIVERSITE DE DROIT ET DE LA SANTE DE LILLE 2 (FR) 2019-01-08 US disclosed
US-20150344498-A1 Spiroisoxazoline Compounds Having an Activity Potentiating the Activity of an Antibiotic UNIVERSITE DE DROIT ET DE LA SANTE DE LILLE 2 (FR) 2015-12-03 US disclosed
US-20150344498-A1 Spiroisoxazoline Compounds Having an Activity Potentiating the Activity of an Antibiotic UNIVERSITE DE DROIT ET DE LA SANTE DE LILLE 2 (FR) 2015-12-03 US disclosed
WO-2014096369-A1 SPIROISOXAZOLINE COMPOUNDS HAVING AN ACTIVITY POTENTIATING THE ACTIVITY OF AN ANTIBIOTIC UNIVERSITE DE DROIT ET DE LA SANTE DE LILLE 2 (FR) 2014-06-26 WO 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-20150344498-A1 Spiroisoxazoline Compounds Having an Activity Potentiating the Activity of an Antibiotic NPPA, CFTR, TCF7 NPC1 143/4885ALDH1A1 1148/4885LMNA 528/4885
US-10174050-B2 Spiroisoxazoline compounds having an activity potentiating the activity of an antibiotic NPPA, CFTR, TCF7 NPC1 143/4885ALDH1A1 1148/4885LMNA 528/4885

“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.