SCHEMBL6357715

SCHEMBL6357715

Cc1cc(-c2ccc(Cl)s2)[c]s1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 3/20 0.34
HSD17B2 P37059 2/20 0.34
PGR P06401 2/20 0.33
CYP2A6 P11509 1/20 0.33
ALDH1A1 P00352 2/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
RAB9A P51151 1/20 0.32
PDGFRB P09619 1/20 0.31
PDGFRA P16234 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
SCHEMBL5727958 0.84 HSD17B1 (0.38) HSD17B1HSD17B2PGRCYP2A6ALDH1A1
SCHEMBL6992007 0.82 NPC1 (0.37) PGRALDH1A1MAPTHSD17B10RAB9A
SCHEMBL144429 0.69 CYP2A6 (0.45) HSD17B1HSD17B2PGRCYP2A6ALDH1A1
SCHEMBL7615770 0.68 ALDH1A1 (0.37) ALDH1A1POLBMAPTL3MBTL1RAB9A
SCHEMBL9193008 0.67 CYP2A6 (0.50) HSD17B1HSD17B2PGRCYP2A6ALDH1A1
SCHEMBL5540662 0.67 CYP2A6 (0.40) HSD17B1HSD17B2CYP2A6ALDH1A1MAPT
SCHEMBL9108694 0.66 PTGS1 (0.33)
SCHEMBL8295556 0.64 HSD17B1 (0.42) HSD17B1HSD17B2PGRCYP2A6ALDH1A1
SCHEMBL128706 0.62
SCHEMBL6084576 0.62 HSD17B1 (0.33) HSD17B1HSD17B2CYP2A6

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-20050256159-A1 1,4-disubstituted piperidine derivatives and their use as 11,betahsd1 inhibitors ASTRAZENECA AB (SE) 2005-11-17 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-20050256159-A1 1,4-disubstituted piperidine derivatives and their use as 11,betahsd1 inhibitors HSD11B1, HSD3B1, P4HA1 HSD17B1 5/4885HSD17B2 9/4885PGR 2858/4885

“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.