SCHEMBL3135089

SCHEMBL3135089

O=C(O)Cc1ccc(C(F)(F)F)cc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 4/20 0.53
RXRB P28702 4/20 0.53
RXRG P48443 4/20 0.53
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
ANO1 Q5XXA6 3/20 0.48
PSEN1 P49768 1/20 0.47
PSEN2 P49810 1/20 0.47
APH1B Q8WW43 1/20 0.47
NCSTN Q92542 1/20 0.47
APH1A Q96BI3 1/20 0.47
PSENEN Q9NZ42 1/20 0.47
AKR1B1 P15121 1/20 0.47
POLQ O75417 2/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
AGBL2 Q5U5Z8 1/20 0.42
THRB P10828 2/20 0.42

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
SCHEMBL30530542 0.87 IDO1 (0.51) RXRARXRBRXRGMEN1KMT2A
SCHEMBL512428 0.87 IDO1 (0.51) RXRARXRBRXRGMEN1KMT2A
SCHEMBL2393327 0.84 POLB (0.54) MEN1KMT2AANO1
SCHEMBL27905706 0.84 RXRA (0.51) RXRARXRBRXRGMEN1KMT2A
SCHEMBL30716953 0.84 POLQ (0.61) RXRARXRBRXRGPSEN1PSEN2
SCHEMBL17899450 0.84 RXRA (0.72) RXRARXRBRXRGPSEN1PSEN2
SCHEMBL30120834 0.84 IDO1 (0.51) RXRARXRBRXRGMEN1KMT2A
SCHEMBL892902 0.84 IDO1 (0.51) RXRARXRBRXRGMEN1KMT2A
SCHEMBL3741058 0.84 POLQ (0.61) RXRARXRBRXRGPSEN1PSEN2
SCHEMBL15524659 0.82 RXRA (0.50) RXRARXRBRXRGMEN1KMT2A

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
WO-2021072156-A1 ORAL COMPLEMENT FACTOR D INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2021-04-15 WO disclosed
US-20100081692-A1 Novel 1-Benzyl-4-Piperidinamines that are Useful in the Treatment of COPD and Asthma ASTRAZENECA AB (SE) 2010-04-01 US disclosed
EP-1945613-A1 NOVEL 1 -BENZYL-4-PIPERIDINAMINES THAT ARE USEFUL IN THE TREATMENT OF COPD AND ASTHMA AstraZeneca AB (SE) 2008-07-23 EP disclosed
WO-2007053082-A1 NOVEL 1 -BENZYL-4-PIPERIDINAMINES THAT ARE USEFUL IN THE TREATMENT OF COPD AND ASTHMA ASTRAZENECA AB (SE) 2007-05-10 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-20100081692-A1 Novel 1-Benzyl-4-Piperidinamines that are Useful in the Treatment of COPD and Asthma CCR1, CCR4, CCR10 RXRA 676/4885RXRB 743/4885RXRG 640/4885

“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.