SCHEMBL19865639

SCHEMBL19865639

CCCCc1ncccc1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.42
TDP1 Q9NUW8 1/20 0.42
KDM1A O60341 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
CYP2D6 P10635 3/20 0.37
CYP19A1 P11511 3/20 0.37
CYP2C9 P11712 3/20 0.37
CYP2C19 P33261 3/20 0.37
CYP3A4 P08684 2/20 0.37
ALDH1A1 P00352 3/20 0.36
NPC1 O15118 2/20 0.36
CASP3 P42574 2/20 0.36
RAB9A P51151 2/20 0.36
SENP8 Q96LD8 2/20 0.36
SENP7 Q9BQF6 2/20 0.36
SENP6 Q9GZR1 2/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL6668385 0.94 TDP1 (0.49) L3MBTL1TDP1KDM1AMAOAMAOB
SCHEMBL22166126 0.93 TDP1 (0.47) L3MBTL1TDP1KDM1AMAOAMAOB
SCHEMBL21076459 0.93 TDP1 (0.47) L3MBTL1TDP1KDM1AMAOAMAOB
SCHEMBL5452167 0.93 TDP1 (0.47) L3MBTL1TDP1KDM1AMAOAMAOB
SCHEMBL19304381 0.93 TDP1 (0.47) L3MBTL1TDP1KDM1AMAOAMAOB
SCHEMBL10116180 0.88 KDM1A (0.43) L3MBTL1KDM1AMAOAMAOBALDH1A1
SCHEMBL26931374 0.82 CYP2A6 (0.48) L3MBTL1KDM1AMAOAMAOBALDH1A1
SCHEMBL23292986 0.81 KDM1A (0.41) L3MBTL1KDM1AMAOAMAOBCYP2D6
SCHEMBL20099885 0.81 CXCR4 (0.49) L3MBTL1KDM1AMAOAMAOBALDH1A1
SCHEMBL11218925 0.81 HRH1 (0.50) KDM1AMAOAMAOBCXCR4

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
WO-2019162391-A1 METHOD FOR PRODUCING FLUORINATED HETEROCYCLIC ALIPHATIC COMPOUNDS Westfälische Wilhelms-Universität Münster (DE) 2019-08-29 WO disclosed
US-20180044343-A1 BICYCLIC IMIDAZOLO DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2018-02-15 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-20180044343-A1 BICYCLIC IMIDAZOLO DERIVATIVE PDE3A, PDE2A, PDE5A L3MBTL1 4405/4885TDP1 32/4885KDM1A 1448/4885

“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.