SCHEMBL7901410

SCHEMBL7901410

CCc1cc(F)ccc1I

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.37
RIPK1 Q13546 3/20 0.37
PKM P14618 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KCNH2 Q12809 2/20 0.36
HTR2A P28223 1/20 0.36
SLC6A4 P31645 1/20 0.36
KDM4E B2RXH2 2/20 0.35
LMNA P02545 2/20 0.35
HTT P42858 2/20 0.35
TP53 P04637 1/20 0.35
ALOX15 P16050 1/20 0.35
MAPK1 P28482 1/20 0.35
HSD17B10 Q99714 1/20 0.35
PARK7 Q99497 1/20 0.34
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33

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
SCHEMBL18688480 0.83 F2RL1 (0.40) MAPTSMN1; SMN2KCNH2HTR2ALMNA
SCHEMBL13186184 0.82 MAPT (0.37) MAPTRIPK1PKMSMN1; SMN2KCNH2
SCHEMBL28982098 0.80 PSEN1 (0.33) HTR2APSEN1PSEN2APH1BNCSTN
SCHEMBL19121076 0.79 TYR (0.43) MAPTHTTTP53ALOX15MEN1
SCHEMBL3667517 0.78 IDO1 (0.40) MAPTRIPK1PKMSMN1; SMN2KCNH2
SCHEMBL23680016 0.77 PSEN1 (0.33) KCNH2HTR2ASLC6A4PSEN1PSEN2
SCHEMBL15273625 0.77 CA3 (0.34) MAPTRIPK1SLC6A4TP53ALOX15
SCHEMBL21383642 0.77 DPP4 (0.33) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL26586563 0.77 IDO1 (0.32) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL13557208 0.77 MAPT (0.37) MAPTRIPK1PKMSMN1; SMN2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3263550-B1 ANILINE DERIVATIVES AND USES THEREOF NISSAN CHEMICAL CORP (JP) 2020-11-25 EP disclosed
US-9957275-B2 Pyrazolo[1,5-A]pyrimidines for antiviral treatment GILEAD SCIENCES, INC. (US) 2018-05-01 US disclosed
US-20170362244-A1 PYRAZOLO[1,5-A]PYRIMIDINES FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. 2017-12-21 US disclosed
WO-2010065717-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-06-10 WO disclosed
US-20090192138-A1 COMPOUNDS BAESCHLIN DANIEL KASPAR 2009-07-30 US disclosed
US-20090192138-A1 COMPOUNDS BAESCHLIN DANIEL KASPAR 2009-07-30 US disclosed
WO-2007071738-A1 CONDENSED HETEROCYCLIC COMPOUNDS USEFUL AS DPP-IV INHIBITORS NOVARTIS AG (CH) 2007-06-28 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 (2 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-20170362244-A1 PYRAZOLO[1,5-A]PYRIMIDINES FOR ANTIVIRAL TREATMENT TYMP, ZC3HAV1, TYMS MAPT 3998/4885RIPK1 1186/4885PKM 729/4885
US-20090192138-A1 COMPOUNDS DPP4, DPP3, DPP8 MAPT 2735/4885RIPK1 3431/4885PKM 1790/4885

“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.