SCHEMBL26417417

SCHEMBL26417417

CC(F)(F)Cc1ccnc(-c2ccccc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ASIC3 Q9UHC3 2/20 0.50
LOXL2 Q9Y4K0 2/20 0.42
HTR1A P08908 1/20 0.41
HTR7 P34969 1/20 0.41
FFAR1 O14842 1/20 0.40
CYP11B1 P15538 2/20 0.40
CYP11B2 P19099 2/20 0.40
PDCD1 Q15116 1/20 0.39
CD274 Q9NZQ7 1/20 0.39
WNT3A P56704 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
SHMT1 P34896 1/20 0.38
IDH1 O75874 1/20 0.38
HCRTR1 O43613 3/20 0.37
HCRTR2 O43614 3/20 0.37
NR3C2 P08235 1/20 0.36
SREBF2 Q12772 1/20 0.36
DUSP10 Q9Y6W6 1/20 0.36

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
SCHEMBL9975654 0.90 ASIC3 (0.53) ASIC3LOXL2HTR1AHTR7FFAR1
SCHEMBL22134624 0.81 ASIC3 (0.44) ASIC3LOXL2HTR1AHTR7PDCD1
SCHEMBL18790907 0.78 ASIC3 (0.47) ASIC3HTR1AHTR7WNT3ASREBF2
SCHEMBL10271516 0.78 ASIC3 (0.53) ASIC3LOXL2HTR1AHTR7FFAR1
Hydrochloric Acid SCHEMBL28148503 0.76 ASIC3 (0.52) ASIC3LOXL2HTR1AHTR7FFAR1
SCHEMBL22134626 0.76 PDCD1 (0.42) ASIC3LOXL2HTR1AHTR7FFAR1
SCHEMBL26172508 0.75 LOXL2 (0.41) ASIC3LOXL2KDM4EALDH1A1SREBF2
SCHEMBL12369304 0.75 ASIC3 (0.47) ASIC3LOXL2HTR1AHTR7FFAR1
SCHEMBL18625006 0.75 ASIC3 (0.47) ASIC3HTR1AHTR7FFAR1CYP11B1
SCHEMBL12747271 0.75 CCR1 (0.43) LOXL2NR3C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11780861-B2 Phosphine reagents for azine fluoroalkylation COLORADO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2023-10-10 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-11780861-B2 Phosphine reagents for azine fluoroalkylation PTPN3, PHOSPHO1, SKIC3 ASIC3 154/4885LOXL2 4362/4885HTR1A 2859/4885

“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.