SCHEMBL19365425

SCHEMBL19365425

CC(=O)N1CCC(c2cccc(NC(=O)N3c4nc(-c5cccc(C(F)(F)F)c5)ccc4N(C)CC[C@H]3C)c2)C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 4/20 0.45
▸ EPHX2 P34913 1/20 0.41
▸ MAPT P10636 3/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ GRIN2B Q13224 1/20 0.39
▸ TRPV4 Q9HBA0 3/20 0.38
▸ GAA P10253 1/20 0.38
▸ ADORA2A P29274 1/20 0.38
▸ ADORA2B P29275 1/20 0.38
▸ ADORA1 P30542 1/20 0.38
▸ NPC1 O15118 1/20 0.37
▸ RHOA P61586 1/20 0.37
▸ SOS1 Q07889 1/20 0.36
▸ JAK2 O60674 1/20 0.36
▸ JAK1 P23458 1/20 0.36

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
SCHEMBL20632111 0.92 MAPT (0.46) MCHR1MAPTMEN1LMNAHTT
SCHEMBL19365423 0.89 MCHR1 (0.44) MCHR1EPHX2MAPTMEN1LMNA
SCHEMBL19365420 0.88 MCHR1 (0.46) MCHR1MAPTMEN1LMNAKMT2A
SCHEMBL16249965 0.86 MCHR1 (0.42) MCHR1EPHX2MAPTMEN1LMNA
SCHEMBL19365904 0.86 MAPT (0.43) MCHR1MAPTMEN1LMNAHTT
SCHEMBL19365254 0.82 HTR2C (0.47) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL19365708 0.82 MAPT (0.41) MCHR1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL19365568 0.82 RHOA (0.50) MAPTMEN1LMNAHTTKMT2A
SCHEMBL19670464 0.81 MAPT (0.40) MCHR1MAPTMEN1LMNAHTT
SCHEMBL19670411 0.81 MAPT (0.41) MAPTLMNAHTTSMN1; SMN2NPC1

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-20180044338-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC (US) 2018-02-15 — — US disclosed
US-9765075-B2 Substituted bridged urea analogs as sirtuin modulators GLAXOSMITHKLINE LLC (US) 2017-09-19 — — 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-20180044338-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 MCHR1 4022/4885EPHX2 4666/4885MAPT 303/4885

“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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