SCHEMBL10067119

SCHEMBL10067119

Cc1cc2c(cn1)CNCC2

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ASIC3 Q9UHC3 2/20 0.43
PNMT P11086 5/20 0.42
CD44 P16070 1/20 0.41
MAOB P27338 1/20 0.41
DRD2 P14416 1/20 0.41
DRD3 P35462 1/20 0.41
ADRA2A P08913 1/20 0.39
ADRA2B P18089 1/20 0.39
ADRA2C P18825 1/20 0.39
HTR2B P41595 1/20 0.38
HTR2C P28335 1/20 0.38
CHRNA7 P36544 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
SCHEMBL18977627 0.92 PNMT (0.43) ASIC3PNMTCD44MAOBDRD2
SCHEMBL20392716 0.84 CHRNA7 (0.39) PNMTCHRNA7
Hydrochloric Acid SCHEMBL31348244 0.82 CHRNA7 (0.38) CHRNA7
SCHEMBL20038301 0.77 PNMT (0.47) ASIC3PNMTCD44MAOBDRD2
SCHEMBL12090705 0.77 PNMT (0.47) ASIC3PNMTCD44MAOBDRD2
SCHEMBL8264642 0.77 ADCY6 (0.47) ASIC3PNMTCD44MAOBDRD2
SCHEMBL25574634 0.77 NOS3 (0.57) ASIC3PNMTCD44MAOBDRD2
SCHEMBL15316126 0.77
SCHEMBL587771 0.77 CHRNB2 (0.44) ASIC3PNMTCD44MAOBDRD2
SCHEMBL18237455 0.77 HTR2B (0.42) ASIC3PNMTCD44MAOBDRD2

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-20230234970-A1 IMMUNOSUPPRESSANT, AND PREPARATION METHOD THEREFOR AND USE THEREOF ABBISKO THERAPEUTICS CO., LTD. (CN) 2023-07-27 US disclosed
US-20170202970-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME BLINKBIO, INC. 2017-07-20 US disclosed
EP-1831199-B1 MMP inhibitors ASTRAZENECA AB (SE) 2012-02-15 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 (2 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-20170202970-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME CD44, MSN, AS3MT ASIC3 876/4885PNMT 863/4885CD44 1/4885
US-20230234970-A1 IMMUNOSUPPRESSANT, AND PREPARATION METHOD THEREFOR AND USE THEREOF CD274, PDCD1, PDCD1LG2 ASIC3 4628/4885PNMT 3983/4885CD44 672/4885

“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.