SCHEMBL18205608

SCHEMBL18205608

Cc1ccc2c(c1O)C(=O)O[C@@H](C)[C@@H]2C

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOA P21397 16/20 0.45
MAOB P27338 7/20 0.42
ELANE P08246 3/20 0.41
CTSG P08311 1/20 0.41
ALDH1A1 P00352 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
SCHEMBL16870532 1.00 MAOA (0.45) MAOAMAOBELANECTSGALDH1A1
SCHEMBL16870512 1.00 MAOA (0.45) MAOAMAOBELANECTSGALDH1A1
SCHEMBL16870423 1.00 MAOA (0.45) MAOAMAOBELANECTSGALDH1A1
SCHEMBL18205655 1.00 MAOA (0.45) MAOAMAOBELANECTSGALDH1A1
SCHEMBL16870455 0.83 MAOA (0.47) MAOAMAOBELANECTSGALDH1A1
SCHEMBL18205649 0.81 MAOA (0.46) MAOAMAOBELANECTSG
SCHEMBL18205652 0.81 MAOA (0.46) MAOAMAOBELANECTSG
SCHEMBL18205691 0.81 MAOA (0.43) MAOAMAOBELANECTSG
SCHEMBL16870392 0.81 MAOA (0.43) MAOAMAOBELANECTSG
SCHEMBL18205651 0.81 MAOA (0.46) MAOAMAOBELANECTSG

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-10167269-B2 Cockroach attraction-aggregation substance, cockroach aggregation attractant and cockroach controlling agent KYOTO UNIVERSITY (JP) 2019-01-01 US disclosed
US-20160326129-A1 COCKROACH ATTRACTION-AGGREGATION SUBSTANCE, COCKROACH AGGREGATION ATTRACTANT AND COCKROACH CONTROLLING AGENT KYOTO UNIVERSITY (JP) 2016-11-10 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 (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-20160326129-A1 COCKROACH ATTRACTION-AGGREGATION SUBSTANCE, COCKROACH AGGREGATION ATTRACTANT AND COCKROACH CONTROLLING AGENT ACHE, STOM, NAPA MAOA 2164/4885MAOB 3324/4885ELANE 746/4885
US-10167269-B2 Cockroach attraction-aggregation substance, cockroach aggregation attractant and cockroach controlling agent ACHE, STOM, NAPA MAOA 2164/4885MAOB 3324/4885ELANE 746/4885

“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.