SCHEMBL17889307

SCHEMBL17889307

CC1CN(c2cccc3nsnc23)CCN1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.41
KMT2A Q03164 4/20 0.41
MAPK1 P28482 3/20 0.41
PKM P14618 2/20 0.41
TSHR P16473 1/20 0.41
GAA P10253 3/20 0.38
MAPT P10636 3/20 0.38
ALDH1A1 P00352 4/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
LMNA P02545 3/20 0.38
KDM4E B2RXH2 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
CYP1A2 P05177 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
MEN1 O00255 1/20 0.37
HSD17B10 Q99714 2/20 0.37
HIF1A Q16665 1/20 0.37
HTR2C P28335 1/20 0.37

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
SCHEMBL4888354 0.80 KMT2A (0.56) KMT2AMAPK1PKMTSHRGAA
Hydrochloric Acid SCHEMBL5251427 0.79 KMT2A (0.55) KMT2AMAPK1PKMTSHRGAA
SCHEMBL4247455 0.74 MKNK1 (0.39) MAPTALDH1A1LMNAHTR2CADRA2A
SCHEMBL23602033 0.74 HTR2A (0.65) TSHRGAAMAPTALDH1A1LMNA
SCHEMBL4246453 0.74 MKNK1 (0.39) MAPTALDH1A1LMNAHTR2CADRA2A
SCHEMBL4885645 0.74 GAA (0.48) KMT2AMAPK1PKMTSHRGAA
SCHEMBL4246451 0.73 DRD2 (0.50) ALDH1A1LMNAHTR2C
SCHEMBL4246449 0.73 DRD2 (0.50) ALDH1A1LMNAHTR2C
SCHEMBL30124391 0.73 ALDH1A1 (0.38) MAPTALDH1A1LMNAHTR2CKHK
SCHEMBL4247449 0.73 DRD2 (0.50) ALDH1A1LMNAHTR2C

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
US-RE48622-E1 Therapeutically active pyrazolo-pyrimidine derivatives UCB Biopharma SRL (BE) 2021-07-06 US disclosed
US-9714248-B2 Therapeutically active pyrazolo-pyrimidine derivatives UCB PHARMA SA (BE) 2017-07-25 US disclosed
US-20160194329-A1 Therapeutically Active Pyrazolo-Pyrimidine Derivatives UCB PHARMA SA (BE) 2016-07-07 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-20160194329-A1 Therapeutically Active Pyrazolo-Pyrimidine Derivatives HAVCR2, TPMT, NFATC1 POLB 1958/4885KMT2A 1873/4885MAPK1 1664/4885

“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.