SCHEMBL21033227

SCHEMBL21033227

O=C(O)c1nn2ccc(C(F)(F)F)nc2c1F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 1/20 0.35
▸ TAS2R14 Q9NYV8 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ PTGER1 P34995 1/20 0.35
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ DPP4 P27487 3/20 0.33
▸ FAP Q12884 2/20 0.33
▸ DPP8 Q6V1X1 2/20 0.33
▸ PTGDR2 Q9Y5Y4 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ ASPH Q12797 1/20 0.32
▸ KDM8 Q8N371 1/20 0.32
▸ P2RX7 Q99572 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ LMNA P02545 1/20 0.31

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
SCHEMBL30845863 0.87 DPP4 (0.34) TGFBR1MAPTNPC1RAB9ADPP4
SCHEMBL21014290 0.83 KDM4E (0.42) MAPTNPC1RAB9AKMT2AKDM4E
SCHEMBL21033308 0.79 HTR6 (0.41) KMT2AKDM4EASPHKDM8ALDH1A1
SCHEMBL16046656 0.75 MAPT (0.40) TGFBR1TAS2R14MAPTPTGER1NPC1
SCHEMBL10697169 0.73 TGFBR1 (0.58) TGFBR1TAS2R14MAPTKDM4EPOLB
SCHEMBL18365964 0.72 TAS2R14 (0.37) TGFBR1TAS2R14MAPTPTGER1NPC1
SCHEMBL5133266 0.69 APOBEC3A (0.49) MAPTPTGER1KMT2AKDM4EALDH1A1
SCHEMBL24518146 0.67 TAS2R14 (0.39) TAS2R14MAPTPTGER1NPC1RAB9A
SCHEMBL22235111 0.67 LMNA (0.39) TAS2R14MAPTP2RX7ALDH1A1LMNA
SCHEMBL30546057 0.67 TAS2R14 (0.39) TAS2R14MAPTPTGER1NPC1RAB9A

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
US-20210371431-A1 HETEROCYCLIC COMPOUNDS AS PRMT5 INHIBITORS JUBILANT EPISCRIBE LLC 2021-12-02 — — US disclosed
WO-2019102494-A1 HETEROCYCLIC COMPOUNDS AS PRMT5 INHIBITORS JUBILANT BIOSYS LIMITED (IN) 2019-05-31 — — 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-20210371431-A1 HETEROCYCLIC COMPOUNDS AS PRMT5 INHIBITORS PRMT5, PRMT1, PRMT3 TGFBR1 1740/4885TAS2R14 2921/4885MAPT 30/4885

“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.

Send feedback