SCHEMBL19699099

SCHEMBL19699099

Cc1cccc(-c2ccc3c(n2)N(C(=O)Nc2cccc(-n4nncc4CN)c2)[C@H]2CCN3C2)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 1/20 0.34
▸ USP2 O75604 1/20 0.34
▸ MAPT P10636 2/20 0.34
▸ KCNJ6 P48051 2/20 0.33
▸ KCNJ3 P48549 2/20 0.33
▸ CCR2 P41597 1/20 0.33
▸ PI4KB Q9UBF8 1/20 0.33
▸ DRD4 P21917 3/20 0.33
▸ TSHR P16473 1/20 0.33
▸ DRD2 P14416 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ HRH3 Q9Y5N1 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ MCL1 Q07820 1/20 0.32
▸ LIMK2 P53671 1/20 0.32

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
SCHEMBL19706250 0.90 KLKB1 (0.32) —
SCHEMBL17624267 0.90 ALDH1A1 (0.36) MAPTKCNJ6KCNJ3CA9MEN1
SCHEMBL19699098 0.84 MEN1 (0.38) MAPTCCR2CA9MEN1KMT2A
SCHEMBL19699039 0.80 HTR2C (0.46) USP2MAPTALDH1A1GAA
SCHEMBL17624573 0.80 MAPT (0.36) MAPTCA9MEN1KMT2APOLB
SCHEMBL16775769 0.79 CNR1 (0.40) MAPTTSHRCA9HRH3KMT2A
SCHEMBL16775764 0.78 IMPDH2 (0.44) USP2LIMK2NPC1RAB9A
SCHEMBL16775784 0.78 IMPDH2 (0.44) USP2LIMK2NPC1RAB9A
SCHEMBL16776343 0.78 HSD11B1 (0.36) HSD11B1CCR2DRD4DRD2CA9
SCHEMBL19669060 0.78 CA9 (0.40) USP2MAPTPI4KBTSHRCA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170355697-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2017-12-14 — — 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-20170355697-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 HSD11B1 3528/4885USP2 218/4885MAPT 267/4885

“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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