SCHEMBL20110650

SCHEMBL20110650

NC1OC(=O)c2cccc(F)c21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
SMARCA2 P51531 1/20 0.36
SMARCA4 P51532 1/20 0.36
PBRM1 Q86U86 1/20 0.36
MAPK1 P28482 1/20 0.36
CYP19A1 P11511 2/20 0.34
TYMS P04818 1/20 0.34
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
AADAT Q8N5Z0 2/20 0.33
MAOA P21397 1/20 0.32
NOTUM Q6P988 1/20 0.32
CUL4A Q13619 1/20 0.32

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
SCHEMBL3744088 0.77 CA1 (0.42) CA1CA2CA7CA9SMARCA2
SCHEMBL10784839 0.73 SMARCA2 (0.37) CA1CA2CA7CA9SMARCA2
SCHEMBL2044047 0.68 MAOB (0.36) CA1CA2CA7CA9CYP19A1
SCHEMBL868796 0.67 ALDH1A1 (0.53) CA1CA2CA9MEN1NPC1
SCHEMBL11255003 0.65 NPC1 (0.42) MAPK1MEN1NPC1RAB9AKMT2A
SCHEMBL30286685 0.64 MAOB (0.40) CA1CA2CA7CA9MEN1
SCHEMBL11808470 0.63 PBRM1 (0.55) CA1CA2CA7CA9SMARCA2
SCHEMBL10716838 0.63 MAOA (0.52) CA1CA2CA7CA9SMARCA2
SCHEMBL5866470 0.63 CA1 (0.52) CA1CA2CA7CA9SMARCA2
SCHEMBL13487412 0.63 CA1 (0.52) CA1CA2CA7CA9MAPK1

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-10662168-B2 Compounds for treating parasitic infections UNIVERSITY OF MARYLAND, COLLEGE PARK (US) 2020-05-26 US disclosed
US-20190152938-A1 COMPOUNDS FOR TREATING PARASITIC INFECTIONS UNIVERSITY OF MARYLAND, COLLEGE PARK 2019-05-23 US disclosed
US-10227320-B2 Compounds for treating parasitic infections UNIVERSITY OF MARYLAND, COLLEGE PARK (US) 2019-03-12 US disclosed
US-20180118704-A1 COMPOUNDS FOR TREATING PARASITIC INFECTIONS UNIVERSITY OF MARYLAND, COLLEGE PARK 2018-05-03 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 (4 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-20190152938-A1 COMPOUNDS FOR TREATING PARASITIC INFECTIONS CYC1, COX15, SLC40A1 CA1 4655/4885CA2 1926/4885CA7 2919/4885
US-20180118704-A1 COMPOUNDS FOR TREATING PARASITIC INFECTIONS CYC1, COX15, SLC40A1 CA1 4655/4885CA2 1926/4885CA7 2919/4885
US-10662168-B2 Compounds for treating parasitic infections CYC1, COX15, SLC40A1 CA1 4655/4885CA2 1926/4885CA7 2919/4885
US-10227320-B2 Compounds for treating parasitic infections CYC1, COX15, SLC40A1 CA1 4655/4885CA2 1926/4885CA7 2919/4885

“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.