SCHEMBL19329369

SCHEMBL19329369

NC(=O)c1ccc2ccc[c]c2n1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.49
PARP1 P09874 4/20 0.37
HTR2B P41595 1/20 0.35
MGAM O43451 1/20 0.34
ALDH1A1 P00352 2/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
LMNA P02545 2/20 0.33
NNMT P40261 1/20 0.33
ACHE P22303 1/20 0.32
LCK P06239 1/20 0.32
KMT2A Q03164 3/20 0.32
KDM4E B2RXH2 2/20 0.32
CNR2 P34972 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
MEN1 O00255 1/20 0.32
PTPN1 P18031 1/20 0.31

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
SCHEMBL20264856 0.74 GRM2 (0.42) PIM1MGAMALDH1A1GAAMAPT
SCHEMBL4473874 0.71 PIM1 (0.41) PIM1PARP1ALDH1A1LMNANNMT
SCHEMBL11972998 0.71 PIM1 (0.38) PIM1PARP1LMNALCKKMT2A
SCHEMBL11973236 0.71 PIM1 (0.38) PIM1LMNANNMTKMT2A
SCHEMBL14955110 0.71 PIM1 (0.38) PIM1PARP1MAPTLMNANNMT
SCHEMBL4484391 0.71 GRM2 (0.35) PIM1LMNANNMTPTPN1
SCHEMBL4358400 0.71 METAP2 (0.31)
SCHEMBL3282411 0.71 NCF1 (0.45)
SCHEMBL3569772 0.70 KDM4E (0.44) PARP1ALDH1A1GAANNMTLCK
SCHEMBL11973582 0.70 PARP1 (0.36) PARP1ALDH1A1LMNANNMTLCK

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-10940468-B2 Nickel catalyst, process for preparation and use thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2021-03-09 US disclosed
WO-2017154022-A1 NOVEL NICKEL CATALYST, PROCESS FOR PREPARATION AND USE THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2017-09-14 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-10940468-B2 Nickel catalyst, process for preparation and use thereof NISCH, NIT2, C9 PIM1 3110/4885PARP1 533/4885HTR2B 3572/4885

“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.