SCHEMBL24512554

SCHEMBL24512554

O=Cc1cccc(Oc2ccc(OC(F)(F)F)cc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.45
PIM1 P11309 1/20 0.44
PIM2 Q9P1W9 1/20 0.44
MAOA P21397 5/20 0.43
MAOB P27338 5/20 0.43
GRK2 P25098 1/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 2/20 0.42
MAPT P10636 2/20 0.42
KMT2A Q03164 2/20 0.42
POLB P06746 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
MAPK14 Q16539 1/20 0.41
TLR4 O00206 1/20 0.41
TLR2 O60603 1/20 0.41
CETP P11597 1/20 0.41

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
SCHEMBL31556430 1.00 SRC (0.45) SRCPIM1PIM2MAOAMAOB
SCHEMBL68710 0.88 PIM1 (0.52) SRCPIM1PIM2MAOAMAOB
SCHEMBL29394922 0.88 PIM1 (0.52) SRCPIM1PIM2MAOAMAOB
SCHEMBL31374872 0.87 ALDH1A1 (0.45) PIM1PIM2GRK2ALDH1A1MAPT
SCHEMBL9270287 0.87 ALDH1A1 (0.45) PIM1PIM2GRK2ALDH1A1MAPT
SCHEMBL27676782 0.87 PIM1 (0.49) SRCPIM1PIM2MAOAMAOB
SCHEMBL6856729 0.86 SRC (0.56) SRCMAOAMAOBNPC1RAB9A
SCHEMBL924185 0.84 ADAMTS5 (0.55) SRCMAOAMAOBNPC1RAB9A
SCHEMBL5537032 0.84 PIM1 (0.41) PIM1PIM2GRK2NPC1RAB9A
SCHEMBL1744566 0.83 PARP10 (0.50) PIM1PIM2ALDH1A1POLBL3MBTL1

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-20220185815-A1 PYRROLOPYRAZOLE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2022-06-16 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-20220185815-A1 PYRROLOPYRAZOLE DERIVATIVE PTDSS1, PTDSS2, SMPD1 SRC 1078/4885PIM1 718/4885PIM2 777/4885

“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.