SCHEMBL29313274

SCHEMBL29313274

CCn1cccc(OC(F)F)c1=O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 1/20 0.38
TNF P01375 1/20 0.37
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
RAB9A P51151 1/20 0.35
ALDH1A1 P00352 2/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPK1 P28482 1/20 0.34
P2RX7 Q99572 3/20 0.34
ADORA2A P29274 1/20 0.33
DRD1 P21728 1/20 0.33
TSHR P16473 1/20 0.33
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL11824740 0.79 ALDH1A1 (0.44) RAB9AALDH1A1ADORA2AMAPT
SCHEMBL20506939 0.77 TNF (0.37) CRHR1TNFMEN1KMT2ARAB9A
SCHEMBL27250319 0.75 PTGS2 (0.40) CRHR1TNFMEN1KMT2AALDH1A1
SCHEMBL29311478 0.70 DRD1 (0.33) TNFMEN1KMT2AALDH1A1HTT
SCHEMBL2645983 0.69 KDM4E (0.40) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL10308970 0.69 PKM (0.49) ALDH1A1KDM4EMAPK1MAPT
SCHEMBL15368193 0.69 ALDH1A1 (0.40) MEN1KMT2AALDH1A1KDM4EMAPK1
SCHEMBL26817055 0.68 MAPT (0.54) MEN1KMT2AALDH1A1HTTSMN1; SMN2
SCHEMBL10308822 0.68 FAAH (0.38) KMT2AALDH1A1KDM4EMAPK1TSHR
SCHEMBL1441164 0.67 ALDH1A1 (0.40) MEN1KMT2AALDH1A1KDM4EMAPK1

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-20240228469-A1 PCSK9 INHIBITORS AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2024-07-11 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-20240228469-A1 PCSK9 INHIBITORS AND METHODS OF USE THEREOF PCSK9, PCSK7, PCSK6 CRHR1 1509/4885TNF 1724/4885MEN1 258/4885

“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.