SCHEMBL23219754

SCHEMBL23219754

CCCCCCC(C)(CC)NCCN1CCCC1=O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.43
ALOX5 P09917 2/20 0.39
RAB9A P51151 3/20 0.37
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPC1 O15118 2/20 0.36
GAA P10253 1/20 0.35
PGK1 P00558 1/20 0.35
MEN1 O00255 1/20 0.35
PIK3CD O00329 1/20 0.35
POLB P06746 1/20 0.34
TDP1 Q9NUW8 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
SCHEMBL20940075 0.95 KMT2A (0.45) KMT2AALOX5RAB9ATSHRSMN1; SMN2
SCHEMBL21790412 0.95 KMT2A (0.45) KMT2AALOX5RAB9ATSHRSMN1; SMN2
SCHEMBL19353009 0.86 KMT2A (0.51) KMT2ARAB9AALDH1A1TSHRSMN1; SMN2
SCHEMBL21790566 0.84 RAB9A (0.44) KMT2ARAB9AALDH1A1SMN1; SMN2NPC1
SCHEMBL18893367 0.78 KMT2A (0.49) KMT2ARAB9AALDH1A1TSHRSMN1; SMN2
SCHEMBL9684758 0.76 KMT2A (0.50) KMT2AALOX5RAB9AALDH1A1TSHR
SCHEMBL4416421 0.76 KMT2A (0.50) KMT2AALOX5RAB9AALDH1A1TSHR
SCHEMBL10245099 0.76 KMT2A (0.55) KMT2ARAB9AALDH1A1TSHRNPC1
SCHEMBL297237 0.75 ALOX5 (0.53) KMT2AALOX5RAB9AGAAMEN1
SCHEMBL430004 0.75 ALOX5 (0.53) KMT2AALOX5RAB9AGAAMEN1

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-10975088-B2 Imidazo[2,1-f][1,2,4]triazine compounds as pi3k-y inhibitors INCYTE CORPORATION (US) 2021-04-13 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-10975088-B2 Imidazo[2,1-f][1,2,4]triazine compounds as pi3k-y inhibitors PIK3R5, PIK3CD, PIK3CA KMT2A 1251/4885ALOX5 1978/4885RAB9A 723/4885

“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.