SCHEMBL3595156

SCHEMBL3595156

Cc1c(C)n(Cc2cccc(F)c2)c2c(N3CCc4ccccc4C3)nc(CO)cc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 3/20 0.42
GRIN3B O60391 3/20 0.42
CHRM1 P11229 3/20 0.42
ADRA1D P25100 3/20 0.42
ADRA1A P35348 3/20 0.42
ADRA1B P35368 3/20 0.42
GRIN1 Q05586 3/20 0.42
GRIN2A Q12879 3/20 0.42
GRIN2B Q13224 3/20 0.42
GRIN2C Q14957 3/20 0.42
GRIN3A Q8TCU5 3/20 0.42
MAPT P10636 4/20 0.37
KDM4E B2RXH2 3/20 0.37
RAB9A P51151 2/20 0.37
MAPK1 P28482 2/20 0.37
POLB P06746 1/20 0.37
NR2F2 P24468 1/20 0.37
ENPP2 Q13822 1/20 0.35
NPC1 O15118 1/20 0.34
FABP3 P05413 1/20 0.34

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
SCHEMBL1738005 0.92 MAPT (0.38) GRIN2DGRIN3BCHRM1ADRA1DADRA1A
Hydrochloric Acid SCHEMBL1737137 0.91 MAPT (0.37) GRIN2DGRIN3BCHRM1ADRA1DADRA1A
SCHEMBL1739799 0.91 MAPT (0.37) GRIN2DGRIN3BCHRM1ADRA1DADRA1A
SCHEMBL1739170 0.91 GRIN2D (0.46) GRIN2DGRIN3BCHRM1ADRA1DADRA1A
Hydrochloric Acid SCHEMBL1736843 0.90 MAPT (0.37) GRIN2DGRIN3BCHRM1ADRA1DADRA1A
SCHEMBL1738725 0.90 MAPT (0.38) GRIN2DGRIN3BCHRM1ADRA1DADRA1A
Hydrochloric Acid SCHEMBL1738735 0.90 GRIN2D (0.45) GRIN2DGRIN3BCHRM1ADRA1DADRA1A
SCHEMBL1735946 0.89 MAPT (0.36) GRIN2DGRIN3BCHRM1ADRA1DADRA1A
Hydrochloric Acid SCHEMBL1736624 0.89 MAPT (0.38) GRIN2DGRIN3BCHRM1ADRA1DADRA1A
SCHEMBL1736974 0.89 EHMT2 (0.36) MAPTKDM4ERAB9AMAPK1POLB

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-8188114-B2 Pyrrolo[2,3-C]pyridine derivatives and processes for the preparation thereof YUHAN CORPORATION (KR) 2012-05-29 US disclosed
US-20100069430-A1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2010-03-18 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-20100069430-A1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF PGA5, ATP6AP1, ATP6V1H GRIN2D 2459/4885GRIN3B 2982/4885CHRM1 3286/4885

“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.