SCHEMBL1671682

SCHEMBL1671682

COCCc1nn2cc(C(F)(F)F)nc2s1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 6/20 0.40
MAPT P10636 5/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
F2RL3 Q96RI0 6/20 0.37
NPC1 O15118 1/20 0.35
PKM P14618 1/20 0.35
ALOX15 P16050 1/20 0.35
RECQL P46063 1/20 0.35
RAB9A P51151 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.33
POLB P06746 1/20 0.33
ALPI P09923 2/20 0.33
ALPL P05186 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
SCHEMBL1672831 0.86 TP53 (0.54) TP53MAPTSMN1; SMN2F2RL3NPC1
SCHEMBL12690055 0.83 TP53 (0.40) TP53MAPTSMN1; SMN2F2RL3NPC1
SCHEMBL20642850 0.80 TP53 (0.37) TP53MAPTSMN1; SMN2F2RL3NPC1
SCHEMBL1672605 0.71 TP53 (0.40) TP53MAPTSMN1; SMN2F2RL3NPC1
SCHEMBL1671683 0.69 POLB (0.35) MAPTPKMPOLB
SCHEMBL1671679 0.66 TP53 (0.58) TP53MAPTSMN1; SMN2F2RL3NPC1
SCHEMBL21138063 0.65 TP53 (0.65) TP53MAPTSMN1; SMN2NPC1PKM
SCHEMBL31597538 0.64 TP53 (0.36) TP53MAPTL3MBTL1
SCHEMBL13204686 0.64 MEN1 (0.55) MAPTNPC1RAB9A
SCHEMBL1672156 0.63 TP53 (0.54) TP53MAPTSMN1; SMN2F2RL3NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2491045-B1 2-OXO-1-PYRROLIDINYL IMIDAZOTHIADIAZOLE DERIVATIVES UCB BIOPHARMA SPRL (BE) 2015-12-23 EP disclosed
US-8822508-B2 2-oxo-1-pyrrolidinyl imidazothiadiazole derivatives UCB PHARMA, S.A. (BE) 2014-09-02 US disclosed
US-20120245208-A1 2-Oxo-1-Pyrrolidinyl Imidazothiadiazole Derivatives UCB PHARMA, S.A. (BE) 2012-09-27 US disclosed
EP-2491045-A1 2-OXO-1-PYRROLIDINYL IMIDAZOTHIADIAZOLE DERIVATIVES UCB Pharma S.A. (BE) 2012-08-29 EP disclosed
WO-2011047860-A1 2-OXO-1-PYRROLIDINYL IMIDAZOTHIADIAZOLE DERIVATIVES UCB PHARMA, S.A. (BE) 2011-04-28 WO 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-20120245208-A1 2-Oxo-1-Pyrrolidinyl Imidazothiadiazole Derivatives CYP3A4, CYP3A43, CYP3A7 TP53 2687/4885MAPT 1016/4885SMN1; SMN2 2662/4885

“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.