SCHEMBL19364819

SCHEMBL19364819

N#Cc1cccc(-c2ccc(N)c(N(C(=O)Nc3cccnc3)C3CCCCC3)n2)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 7/20 0.47
▸ ATR Q13535 2/20 0.45
▸ PRKDC P78527 1/20 0.43
▸ HDAC2 Q92769 2/20 0.40
▸ ABL1 P00519 2/20 0.39
▸ PDGFRB P09619 2/20 0.39
▸ BCR P11274 2/20 0.39
▸ PDGFRA P16234 2/20 0.39
▸ SRC P12931 1/20 0.39
▸ HDAC3 O15379 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ SGMS2 Q8NHU3 1/20 0.39
▸ PRKCA P17252 1/20 0.38
▸ BRAF P15056 1/20 0.38
▸ CYP11B1 P15538 2/20 0.38
▸ CYP11B2 P19099 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ TSHR P16473 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
SCHEMBL19365604 0.89 HDAC1 (0.46) ATRHDAC2ABL1PDGFRBBCR
SCHEMBL19365379 0.89 HDAC2 (0.44) MCHR1ATRPRKDCHDAC2
SCHEMBL19365297 0.88 HDAC2 (0.41) MCHR1ATRPRKDCHDAC2HDAC3
SCHEMBL19365310 0.87 TSHR (0.45) MCHR1ATRHDAC2ABL1PDGFRB
SCHEMBL19365519 0.86 POLB (0.46) MCHR1HDAC2ABL1PDGFRBBCR
SCHEMBL19365747 0.85 MCHR1 (0.41) MCHR1ATRPRKDCHDAC2
SCHEMBL19364891 0.85 MCHR1 (0.42) MCHR1ATRPRKDCHDAC2
SCHEMBL19365569 0.85 MCHR1 (0.41) MCHR1ATRPRKDCHDAC2
SCHEMBL19365726 0.84 ATM (0.40) ATRPRKDCHDAC2HDAC3HDAC1
SCHEMBL19670509 0.82 HDAC1 (0.41) HDAC2ABL1PDGFRBBCRPDGFRA

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
US-10590135-B2 Substituted bridged urea analogs as sirtuin modulators GLAXOSMITHKLINE LLC (US) 2020-03-17 — — US disclosed
US-20180044338-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC (US) 2018-02-15 — — US disclosed
US-20170355697-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2017-12-14 — — US disclosed
US-9834558-B2 Substituted bridged urea analogs as sirtuin modulators GLAXOSMITHKLINE LLC (US) 2017-12-05 — — 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 (3 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 4022/4885ATR 1768/4885PRKDC 3888/4885
US-20170355697-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 MCHR1 4256/4885ATR 1867/4885PRKDC 4088/4885
US-10590135-B2 Substituted bridged urea analogs as sirtuin modulators SIRT1, SIRT3, SIRT2 MCHR1 4256/4885ATR 1867/4885PRKDC 4088/4885

“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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