SCHEMBL16804977

SCHEMBL16804977

CCOC(=O)c1cc(-c2cc(Cl)cnc2C)n(C)n1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.51
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ NPC1 O15118 3/20 0.46
▸ RAB9A P51151 3/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ MMP2 P08253 1/20 0.43
▸ MMP13 P45452 1/20 0.43
▸ MMP14 P50281 1/20 0.43
▸ MAPT P10636 2/20 0.42
▸ FAAH O00519 2/20 0.42
▸ CHRNA7 P36544 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.40
▸ GPR55 Q9Y2T6 1/20 0.40
▸ KMT2A Q03164 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ NOTUM Q6P988 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
SCHEMBL15869830 0.81 CHRNA7 (0.47) LMNASMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL16804979 0.81 LMNA (0.46) LMNASMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL16783072 0.80 LMNA (0.43) LMNASMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL3435464 0.79 MAPT (0.50) SMN1; SMN2NPC1RAB9AKDM4EMAPT
SCHEMBL17319161 0.79 HTR2A (0.45) LMNAMMP2MMP13MMP14MAPT
SCHEMBL5023193 0.77 CHRNA7 (0.60) SMN1; SMN2NPC1RAB9AMMP2MMP13
SCHEMBL16808954 0.77 LMNA (0.43) LMNASMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL17383969 0.77 PLA2G10 (0.54) LMNASMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL16804975 0.76 MMP2 (0.42) LMNASMN1; SMN2NPC1RAB9AMMP2
SCHEMBL16783014 0.76 FAAH (0.44) LMNASMN1; SMN2NPC1RAB9AMMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015090579-A1 PYRAZOLYL-BASED CARBOXAMIDES IV Grünenthal GmbH (DE) 2015-06-25 — — WO disclosed
US-20150166505-A1 PYRIDINYL-SUBSTITUTED PYRAZOLYL CARBOXAMIDES Grünenthal GmbH (DE) 2015-06-18 — — US disclosed
US-20150166505-A1 PYRIDINYL-SUBSTITUTED PYRAZOLYL CARBOXAMIDES Grünenthal GmbH (DE) 2015-06-18 — — 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-20150166505-A1 PYRIDINYL-SUBSTITUTED PYRAZOLYL CARBOXAMIDES AADAC, NLRP3, NOD2 LMNA 738/4885SMN1; SMN2 2629/4885NPC1 599/4885

“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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