SCHEMBL23516612

SCHEMBL23516612

O=C(NC1CCn2c(C(=O)Nc3ccc(F)c(Cl)c3)ccc21)OCc1ccccn1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.47
RAB9A P51151 4/20 0.46
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MALT1 Q9UDY8 7/20 0.45
LMNA P02545 1/20 0.40
IDO1 P14902 1/20 0.40
GRM4 Q14833 1/20 0.39
EGFR P00533 1/20 0.39
ALDH1A1 P00352 2/20 0.38
KCNJ6 P48051 1/20 0.38
KCNJ5 P48544 1/20 0.38
KCNJ3 P48549 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 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
SCHEMBL30360004 1.00 NPC1 (0.47) NPC1RAB9AMAPTSMN1; SMN2MALT1
SCHEMBL23516554 0.83 MALT1 (0.40) NPC1RAB9AMAPTSMN1; SMN2MALT1
SCHEMBL23516703 0.83 MEN1 (0.46) NPC1RAB9AMAPTSMN1; SMN2MALT1
SCHEMBL31020187 0.83 MEN1 (0.46) NPC1RAB9AMAPTSMN1; SMN2MALT1
SCHEMBL19973967 0.80 NPC1 (0.45) NPC1RAB9AMAPTSMN1; SMN2MALT1
SCHEMBL21633710 0.80 KMT2A (0.48) NPC1RAB9AMAPTSMN1; SMN2MALT1
SCHEMBL26597479 0.79 NPC1 (0.47) NPC1RAB9AMAPTSMN1; SMN2MALT1
SCHEMBL20511865 0.79 NPC1 (0.47) NPC1RAB9AMAPTSMN1; SMN2MALT1
SCHEMBL26717793 0.78 NPC1 (0.47) NPC1RAB9AMAPTSMN1; SMN2MALT1
SCHEMBL26705986 0.78 NPC1 (0.48) NPC1RAB9AMAPTSMN1; SMN2MALT1

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-11566002-B2 Substituted tetrahydrocyclopenta[C]pyrroles, substituted dihydropyrrolizines, analogues thereof, and methods using same ARBUTUS BIOPHARMA CORPORATION (CA) 2023-01-31 US disclosed
US-20210179557-A1 SUBSTITUTED TETRAHYDROCYCLOPENTA[C]PYRROLES, SUBSTITUTED DIHYDROPYRROLIZINES, ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2021-06-17 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-20210179557-A1 SUBSTITUTED TETRAHYDROCYCLOPENTA[C]PYRROLES, SUBSTITUTED DIHYDROPYRROLIZINES, ANALOGUES THEREOF, AND METHODS USING SAME DHPS, HMBS, HAVCR2 NPC1 667/4885RAB9A 863/4885MAPT 2409/4885
US-11566002-B2 Substituted tetrahydrocyclopenta[C]pyrroles, substituted dihydropyrrolizines, analogues thereof, and methods using same DHPS, HMBS, HAVCR2 NPC1 667/4885RAB9A 863/4885MAPT 2409/4885

“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.