SCHEMBL20176225

SCHEMBL20176225

Brc1nc2cc3nc(Br)sc3cc2s1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.54
NPC1 O15118 4/20 0.54
ALDH1A1 P00352 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
MAPT P10636 3/20 0.54
TP53 P04637 2/20 0.54
PKM P14618 1/20 0.54
HPGD P15428 1/20 0.54
HSD17B10 Q99714 1/20 0.54
HDAC6 Q9UBN7 1/20 0.39
GAA P10253 3/20 0.39
MAPK1 P28482 1/20 0.39
CYP3A4 P08684 2/20 0.37
TSHR P16473 1/20 0.37
APP P05067 3/20 0.32
HTT P42858 2/20 0.32
DYRK1A Q13627 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL18315218 0.92 RAB9A (0.46) RAB9ANPC1ALDH1A1SMN1; SMN2MAPT
SCHEMBL17839736 0.77 ILK (0.49) RAB9ANPC1ALDH1A1SMN1; SMN2MAPT
SCHEMBL19783421 0.75 STING1 (0.49) RAB9ANPC1ALDH1A1SMN1; SMN2MAPT
SCHEMBL17836733 0.75 DYRK1A (0.53) RAB9ANPC1ALDH1A1MAPTGAA
SCHEMBL2098849 0.75 RAB9A (0.56) RAB9ANPC1ALDH1A1SMN1; SMN2MAPT
SCHEMBL19782524 0.74 HSD17B1 (0.36) RAB9ANPC1ALDH1A1SMN1; SMN2MAPT
SCHEMBL1637655 0.74 MAPT (0.38) RAB9ANPC1ALDH1A1SMN1; SMN2MAPT
SCHEMBL7409329 0.72 SMN1; SMN2 (0.58) RAB9ANPC1ALDH1A1SMN1; SMN2MAPT
SCHEMBL2432396 0.72 F2RL3 (0.51) RAB9ANPC1ALDH1A1SMN1; SMN2MAPT
SCHEMBL9305718 0.72 SMN1; SMN2 (0.53) RAB9ANPC1ALDH1A1SMN1; SMN2MAPT

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
EP-3327812-B1 PHOTOELECTRIC CONVERSION ELEMENT, SOLAR CELL AND COMPOUND FUJIFILM CORP (JP) 2019-02-20 EP disclosed
EP-3327812-A1 PHOTOELECTRIC CONVERSION ELEMENT, SOLAR CELL AND COMPOUND Fujifilm Corporation (JP) 2018-05-30 EP disclosed
US-20180144877-A1 PHOTOELECTRIC CONVERSION ELEMENT, SOLAR CELL, AND COMPOUND FUJIFILM CORPORATION (JP) 2018-05-24 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-20180144877-A1 PHOTOELECTRIC CONVERSION ELEMENT, SOLAR CELL, AND COMPOUND SLC9A1, SLC9A2, SLC26A3 RAB9A 593/4885NPC1 420/4885ALDH1A1 2172/4885

“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.