SCHEMBL3976510

SCHEMBL3976510

C[C@H](c1ccccc1)N1C(=O)C(F)[C@](C)(C(=O)O)C1C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 2/20 0.34
HPGD P15428 1/20 0.34
KCNA5 P22460 1/20 0.34
MAPT P10636 1/20 0.33
CYP2D6 P10635 2/20 0.32
CYP2C19 P33261 1/20 0.32
TSHR P16473 1/20 0.32
GLA P06280 1/20 0.32
CYP2C9 P11712 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HSD11B1 P28845 1/20 0.31
RIPK1 Q13546 1/20 0.31
DPP4 P27487 1/20 0.30
DPP7 Q9UHL4 1/20 0.30

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
SCHEMBL3977729 0.86 KMT2A (0.36) KMT2AALDH1A1HPGDKCNA5MAPT
SCHEMBL741450 0.81 KCNA5 (0.34) KMT2AALDH1A1HPGDKCNA5MAPT
SCHEMBL740950 0.77 KCNA5 (0.31) KMT2AKCNA5
SCHEMBL2242527 0.76 KCNA5 (0.31) KCNA5
SCHEMBL3974320 0.76 CHRM2 (0.39) KMT2AALDH1A1HPGDMAPTCYP2D6
SCHEMBL3978378 0.76 KCNA5 (0.37) KMT2AALDH1A1HPGDKCNA5MAPT
SCHEMBL741115 0.74 CHRM2 (0.32) KMT2AMAPT
SCHEMBL739248 0.73 KMT2A (0.41) KMT2AALDH1A1HPGDKCNA5MAPT
SCHEMBL741947 0.73 KMT2A (0.41) KMT2AALDH1A1HPGDKCNA5MAPT
SCHEMBL3977158 0.73 KCNA5 (0.37) KMT2AALDH1A1HPGDKCNA5MAPT

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-7563805-B2 7-[3-Amino-3,4-dimethylpyrrolidine-1-yl]-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-1,4-dihydro-8-methyl-4-oxoquinoline-3-carboxylic acid: quinoline bactericide; broad spectrum, strong antibacterial activity for Grampositive/-negative including multiple resistant cocci; side effect reductcion; drug design DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-07-21 US disclosed
US-20060264428-A1 Tri-, tetra-substituted-3-aminopyrrolidine derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-11-23 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 (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-20060264428-A1 Tri-, tetra-substituted-3-aminopyrrolidine derivative QTRT1, RRS1, LAS1L KMT2A 2638/4885ALDH1A1 3966/4885HPGD 2443/4885

“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.