SCHEMBL17229307

SCHEMBL17229307

CC(C)Cc1cc(Cl)ccc1-n1cncn1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.50
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
HSP90AA1 P07900 1/20 0.43
MAPT P10636 1/20 0.43
PKM P14618 1/20 0.43
HPGD P15428 1/20 0.43
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
APOBEC3A P31941 1/20 0.42
APOBEC3G Q9HC16 1/20 0.42
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL17232477 0.84 L3MBTL1 (0.50) F2APOBEC3AAPOBEC3GCRHBPCRHR2
SCHEMBL6926426 0.84 F2 (0.45) F2ALDH1A1APOBEC3AAPOBEC3GCRHBP
SCHEMBL14438338 0.82 F2 (0.52) F2APOBEC3AAPOBEC3GCRHBPCRHR2
SCHEMBL6930684 0.81 F2 (0.47) F2ALDH1A1APOBEC3AAPOBEC3GCRHBP
SCHEMBL1197438 0.81 CRHBP (0.44) F2ALDH1A1APOBEC3AAPOBEC3GCRHBP
SCHEMBL14452034 0.80 F2 (0.50) F2APOBEC3AAPOBEC3GCRHBPCRHR2
SCHEMBL7475009 0.78 F2 (0.47) F2ALDH1A1APOBEC3AAPOBEC3GCRHBP
SCHEMBL21004956 0.78 APOBEC3A (0.44) ALDH1A1APOBEC3AAPOBEC3GCRHBPCRHR2
SCHEMBL19067640 0.77 NOTUM (0.45) F2ALDH1A1LMNAMAPTMAPK1
SCHEMBL6930547 0.77 F2 (0.42) F2APOBEC3AAPOBEC3GCRHBPCRHR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9695166-B2 Pyrazolopyridine pyrazolopyrimidine and related compounds GLOBAL BLOOD THERAPEUTICS, INC. (US) 2017-07-04 US disclosed
WO-2015171527-A1 PYRAZOLOPYRIDINE PYRAZOLOPYRIMIDINE AND RELATED COMPOUNDS GLOBAL BLOOD THERAPEUTICS, INC. (US) 2015-11-12 WO disclosed
US-20150315198-A1 PYRAZOLOPYRIDINE PYRAZOLOPYRIMIDINE AND RELATED COMPOUNDS GLOBAL BLOOD THERAPEUTICS, INC. (US) 2015-11-05 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-20150315198-A1 PYRAZOLOPYRIDINE PYRAZOLOPYRIMIDINE AND RELATED COMPOUNDS TPMT, DPYD, XDH F2 201/4885ALDH1A1 416/4885LMNA 3428/4885

“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.