SCHEMBL12124285

SCHEMBL12124285

Cc1ccc(C(=O)NCCC(=O)C2CCCCC2)s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ NPC1 O15118 5/20 0.49
▸ RAB9A P51151 5/20 0.49
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ ALDH1A1 P00352 3/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ USP2 O75604 1/20 0.49
▸ NAMPT P43490 2/20 0.46
▸ LMNA P02545 2/20 0.45
▸ RECQL P46063 1/20 0.45
▸ HDAC3 O15379 1/20 0.44
▸ HDAC4 P56524 1/20 0.44
▸ HDAC1 Q13547 1/20 0.44
▸ HDAC6 Q9UBN7 1/20 0.44
▸ HPGD P15428 2/20 0.44
▸ TP53 P04637 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ CACNA1H O95180 1/20 0.43

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
SCHEMBL15296736 0.79 POLB (0.59) POLBKMT2ATDP1NPC1RAB9A
SCHEMBL279950 0.77 KMT2A (0.71) POLBKMT2ATDP1NPC1RAB9A
SCHEMBL12124247 0.76 ALDH1A1 (0.52) POLBKMT2ATDP1NPC1RAB9A
SCHEMBL12124283 0.76 RAB9A (0.75) POLBKMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL12124252 0.75 ALDH1A1 (0.53) POLBKMT2ATDP1NPC1RAB9A
SCHEMBL16523476 0.75 POLB (0.58) POLBKMT2ATDP1NPC1RAB9A
SCHEMBL12124255 0.74 RAB9A (0.77) POLBKMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL11904430 0.74 NPC1 (0.49) POLBKMT2ATDP1NPC1RAB9A
SCHEMBL12124267 0.74 POLB (0.65) POLBKMT2ATDP1NPC1RAB9A
SCHEMBL12124440 0.74 KMT2A (0.65) POLBKMT2ATDP1NPC1RAB9A

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-20110281865-A1 NOVEL 3,5-DISUBSTITUTED-3H-IMIDAZO[4,5-B]PYRIDINE AND 3,5- DISUBSTITUTED -3H-[1,2,3]TRIAZOLO[4,5-B] PYRIDINE COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS SA (CH) 2011-11-17 — — 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-20110281865-A1 NOVEL 3,5-DISUBSTITUTED-3H-IMIDAZO[4,5-B]PYRIDINE AND 3,5- DISUBSTITUTED -3H-[1,2,3]TRIAZOLO[4,5-B] PYRIDINE COMPOUNDS AS MODULATORS OF PROTEIN KINASES MAP4K2, MAP4K3, MAP3K1 POLB 2582/4885KMT2A 2734/4885TDP1 1496/4885

“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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