SCHEMBL5519339

SCHEMBL5519339

O=C(NC[C@H]1CC[C@@H](CCOc2ccccc2)CC1)c1ccn[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.52
ALOX15 P16050 2/20 0.43
NPC1 O15118 1/20 0.43
CDK2 P24941 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TEAD1 P28347 1/20 0.43
TEAD3 Q99594 1/20 0.43
APOBEC3A P31941 1/20 0.42
APOBEC3G Q9HC16 1/20 0.42

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
SCHEMBL5519345 1.00 AR (0.52) ARALOX15NPC1CDK2RAB9A
SCHEMBL22372145 0.83 AR (0.57) ARALOX15NPC1CDK2RAB9A
SCHEMBL5527710 0.81 NPC1L1 (0.47) NPC1RAB9ASMN1; SMN2TEAD1TEAD3
SCHEMBL5527711 0.81 NPC1L1 (0.47) NPC1RAB9ASMN1; SMN2TEAD1TEAD3
SCHEMBL5527889 0.78 KMT2A (0.45)
SCHEMBL5527884 0.78 KMT2A (0.45)
SCHEMBL5525148 0.78 HIF1A (0.44) TEAD1TEAD3
SCHEMBL5523261 0.78 HIF1A (0.44) TEAD1TEAD3
SCHEMBL5525155 0.78 HIF1A (0.44) TEAD1TEAD3
SCHEMBL5523265 0.78 HIF1A (0.44) TEAD1TEAD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070167452-A1 Therapeutic amide derivatives PFIZER, INC. 2007-07-19 US disclosed
US-20070167452-A1 Therapeutic amide derivatives PFIZER, INC. 2007-07-19 US disclosed
US-20070167452-A1 Therapeutic amide derivatives PFIZER, INC. 2007-07-19 US disclosed
WO-2005080317-A2 THERAPEUTIC AMIDE DERIVATIVES PFIZER JAPAN, INC. (JP) 2005-09-01 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 (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-20070167452-A1 Therapeutic amide derivatives GRIN1, GRIN2B, GRIN3A AR 1299/4885ALOX15 2819/4885NPC1 1340/4885

“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.