SCHEMBL4131102

SCHEMBL4131102

COc1cccc(C(O)c2cc(Cl)ccc2N)c1OC(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 4/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
LPAR1 Q92633 3/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
KCNK3 O14649 1/20 0.33
KCNK9 Q9NPC2 1/20 0.33

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
SCHEMBL4119685 0.91 FDFT1 (0.37) FDFT1ALDH1A1MAPTLPAR1MEN1
SCHEMBL4679921 0.88 ALDH1A1 (0.43) FDFT1ALDH1A1MAPTLPAR1MEN1
SCHEMBL4111096 0.88 ALDH1A1 (0.43) FDFT1ALDH1A1MAPTLPAR1MEN1
SCHEMBL4123117 0.85 FDFT1 (0.36) FDFT1ALDH1A1MAPTLPAR1MEN1
SCHEMBL4111604 0.83 MAPT (0.43) FDFT1ALDH1A1MAPTLPAR1MEN1
SCHEMBL4111638 0.83 MAP2 (0.35) ALDH1A1KCNK3KCNK9
SCHEMBL4119040 0.83 MAP2 (0.39) ALDH1A1KCNK3KCNK9
SCHEMBL4117720 0.83 LPAR1 (0.38) ALDH1A1MAPTLPAR1KMT2A
SCHEMBL4124759 0.82 ALDH1A1 (0.42) ALDH1A1MAPTMEN1KMT2AATM
SCHEMBL4122138 0.82 TDP1 (0.42) FDFT1ALDH1A1MAPTLPAR1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090181942-A1 TRICYCLIC COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-07-16 US disclosed
US-20090181942-A1 TRICYCLIC COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-07-16 US disclosed
US-20090181942-A1 TRICYCLIC COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-07-16 US disclosed
EP-1939205-A1 TRICYCLIC COMPOUND Daiichi Sankyo Company, Limited (JP) 2008-07-02 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-20090181942-A1 TRICYCLIC COMPOUNDS FDFT1, COASY, HMGCR FDFT1 1/4885ALDH1A1 1587/4885MAPT 4428/4885

“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.