SCHEMBL9987932

SCHEMBL9987932

C#Cc1ccc(C(C)N)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.50
PDE2A O00408 1/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA4 P22748 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40
HDAC8 Q9BY41 2/20 0.39
CYP2C9 P11712 1/20 0.33
ROCK2 O75116 2/20 0.33
ROCK1 Q13464 2/20 0.33
CIT O14578 1/20 0.31
GABRP O00591 1/20 0.31
GABRD O14764 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31

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
SCHEMBL22954544 1.00 ADRB2 (0.50) ADRB2PDE2ACA12CA1CA2
SCHEMBL24017079 0.80 DPP4 (0.43) CA12CA1CA2CA4CA9
SCHEMBL2010094 0.80 DPP4 (0.43) CA12CA1CA2CA4CA9
SCHEMBL24017078 0.80 DPP4 (0.43) CA12CA1CA2CA4CA9
SCHEMBL28321091 0.80 ESR1 (0.46) CA12CA1CA2CA4CA9
SCHEMBL624888 0.80 PYCR1 (0.42) CA12CA1CA2CA4CA9
SCHEMBL27207789 0.80 ADRB2 (0.54) ADRB2PDE2A
SCHEMBL30885664 0.80 ADRB2 (0.54) ADRB2PDE2A
SCHEMBL1314596 0.79 ADRB2 (0.72) ADRB2PDE2AROCK2ROCK1CIT
SCHEMBL319930 0.76 ADRB2 (0.50) ADRB2PDE2ACA12CA2CA9

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-20250197387-A1 BCL-XL DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2025-06-19 US disclosed
EP-1966156-B1 NEW COMPOUNDS III ASTRAZENECA AB (SE) 2011-12-21 EP 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-20250197387-A1 BCL-XL DEGRADERS AND USES THEREOF XIAP, BCL2L1, BCL2L10 ADRB2 4868/4885PDE2A 4738/4885CA12 3826/4885

“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.