SCHEMBL5773257

SCHEMBL5773257

CCOC(=O)c1cnoc1-c1ccc(Cl)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
TSHR P16473 2/20 0.51
HSD17B10 Q99714 2/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
POLB P06746 1/20 0.51
KDM4E B2RXH2 3/20 0.50
TDP1 Q9NUW8 1/20 0.45
CDC7 O00311 1/20 0.45
DBF4 Q9UBU7 1/20 0.45
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
KMT2A Q03164 2/20 0.42
DPP4 P27487 1/20 0.42
DPP8 Q6V1X1 1/20 0.42
DPP9 Q86TI2 1/20 0.42
HTT P42858 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
SCHEMBL5770512 0.90 MAPT (0.45) MAPTSMN1; SMN2TSHRHSD17B10NPC1
SCHEMBL4368062 0.86 ALPL (0.49) MAPTKDM4EALDH1A1HPGD
SCHEMBL11382394 0.85 ALOX5 (0.49) MAPTTSHRHSD17B10KDM4ETDP1
SCHEMBL10668171 0.82 SMN1; SMN2 (0.52) MAPTSMN1; SMN2HSD17B10NPC1RAB9A
SCHEMBL5775490 0.80 ALOX5 (0.52) MAPTSMN1; SMN2KDM4ECYP3A4CYP2C9
SCHEMBL11374342 0.80 NPC1 (0.39) MAPTSMN1; SMN2TSHRNPC1RAB9A
SCHEMBL4371450 0.80 SMN1; SMN2 (0.50) SMN1; SMN2TSHRHSD17B10NPC1RAB9A
SCHEMBL5770551 0.79 SMN1; SMN2 (0.44) MAPTSMN1; SMN2TSHRHSD17B10NPC1
SCHEMBL5772630 0.79 ALOX5 (0.51) SMN1; SMN2HSD17B10NPC1RAB9APOLB
SCHEMBL5775425 0.79 CYP4F2 (0.45) SMN1; SMN2TSHRHSD17B10NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4243406-A REDUCING INJURIES TO CROP PLANTS WHEN USING AN ALPHA-HALOACETANILIDE AS A HERBICIDE MONSANTO COMPANY (US) 1981-01-06 US claimed
US-20060084690-A1 Isoxazole derivatives MOMOSE YU 2006-04-20 US disclosed
US-7022725-B2 Isoxazole derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-04-04 US disclosed
US-20040048908-A1 Isoxazole derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-03-11 US disclosed
EP-1340749-A1 ISOXAZOLE DERIVATIVES Takeda Chemical Industries, Ltd. (JP) 2003-09-03 EP disclosed
US-4731109-A Herbicidal 2-haloacetanilides MONSANTO COMPANY (US) 1988-03-15 US disclosed
US-4243406-A REDUCING INJURIES TO CROP PLANTS WHEN USING AN ALPHA-HALOACETANILIDE AS A HERBICIDE MONSANTO COMPANY (US) 1981-01-06 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-20060084690-A1 Isoxazole derivatives INSR, GPR119, INSRR MAPT 4701/4885SMN1; SMN2 3383/4885TSHR 534/4885
US-20040048908-A1 Isoxazole derivatives GPR119, INSR, IRS1 MAPT 4763/4885SMN1; SMN2 2449/4885TSHR 583/4885

“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.