SCHEMBL6822208

SCHEMBL6822208

CC(C)n1nc(-c2c(-c3ccccc3)nn3ccc(C(=O)NC4CCCCCC4)cc23)ccc1=O

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.42
CNR2 P34972 3/20 0.42
ADORA1 P30542 2/20 0.41
ADORA2A P29274 1/20 0.41
MAPT P10636 1/20 0.41
TACR2 P21452 1/20 0.40
TACR3 P29371 1/20 0.40
OPRM1 P35372 1/20 0.40
PIN1 Q13526 3/20 0.39
MAPK8 P45983 1/20 0.39
MAPK9 P45984 1/20 0.39
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL6824733 0.96 ADORA1 (0.43) ADORA1ADORA2ASMN1; SMN2MEN1KMT2A
SCHEMBL6822105 0.87 ADORA1 (0.43) ADORA1ADORA2AALDH1A1POLB
SCHEMBL6822494 0.86 ADORA1 (0.43) ADORA1ALDH1A1POLB
SCHEMBL6818544 0.86 ADORA1 (0.46) ADORA1SMN1; SMN2POLBKMT2A
SCHEMBL6822104 0.84 SMN1; SMN2 (0.42) ADORA1PIN1ALDH1A1SMN1; SMN2MEN1
SCHEMBL6818603 0.84 SMN1; SMN2 (0.42) ADORA1PIN1ALDH1A1SMN1; SMN2MEN1
SCHEMBL6822341 0.84 ADORA1 (0.42) ADORA1ALDH1A1
SCHEMBL6824869 0.84 ADORA1 (0.42) ADORA1MAPK8MAPK9ALDH1A1POLB
SCHEMBL6821915 0.83 SMN1; SMN2 (0.41) ADORA1ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL6822338 0.83 MEN1 (0.49) ADORA1ADORA2AMAPTMEN1KMT2A

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-20040110763-A1 Pyrazolopyridine compound and pharmaceutical use thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-06-10 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-20040110763-A1 Pyrazolopyridine compound and pharmaceutical use thereof ADRB1, ADRA1D, ADRB3 CNR1 534/4885CNR2 454/4885ADORA1 22/4885

“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.