SCHEMBL19880682

SCHEMBL19880682

ISOCCCCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 1/20 0.48
▸ MAOA P21397 1/20 0.47
▸ MAOB P27338 2/20 0.45
▸ SIGMAR1 Q99720 4/20 0.44
▸ FFAR1 O14842 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ ALOX12 P18054 1/20 0.43
▸ CASP1 P29466 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ LMNA P02545 1/20 0.42

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
SCHEMBL19880675 0.98 SIGMAR1 (0.47) IDO1MAOAMAOBSIGMAR1FFAR1
SCHEMBL19880725 0.94 IDO1 (0.55) IDO1MAOAMAOBSIGMAR1FFAR1
SCHEMBL19880687 0.85 ALDH1A1 (0.48) IDO1MAOAMAOBALDH1A1HPGD
SCHEMBL20749354 0.80 IDO1 (0.53) IDO1MAOAMAOBSIGMAR1FFAR1
SCHEMBL20749180 0.78 IDO1 (0.52) IDO1MAOAMAOBSIGMAR1L3MBTL1
SCHEMBL18458925 0.78 L3MBTL1 (0.49) IDO1MAOASIGMAR1L3MBTL1TDP1
SCHEMBL22784212 0.77 IDO1 (0.54) IDO1MAOAMAOBSIGMAR1FFAR1
SCHEMBL198056 0.76 IDO1 (0.58) IDO1MAOAMAOBSIGMAR1L3MBTL1
SCHEMBL21472357 0.76 TSHR (0.54) IDO1ALDH1A1L3MBTL1TDP1
SCHEMBL451456 0.75 MAOA (0.74) IDO1MAOAMAOBSIGMAR1ALDH1A1

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-9895454-B2 Metal oxide catalyzed radiofluorination THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-02-20 — — US disclosed
US-20170224851-A1 METAL OXIDE CATALYZED RADIOFLUORINATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-08-10 — — 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-20170224851-A1 METAL OXIDE CATALYZED RADIOFLUORINATION TRHDE, TPO, TERT IDO1 818/4885MAOA 167/4885MAOB 203/4885

“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.

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