SCHEMBL6399270

SCHEMBL6399270

CC(=O)CCC(=S)Nc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.53
TAS2R38 P59533 2/20 0.53
NAPRT Q6XQN6 1/20 0.53
GAA P10253 3/20 0.53
EPHX1 P07099 2/20 0.53
CYP3A4 P08684 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
MAPT P10636 3/20 0.50
ALDH1A1 P00352 5/20 0.49
ABAT P80404 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
TAAR1 Q96RJ0 1/20 0.47
POLB P06746 1/20 0.47
TP53 P04637 1/20 0.47
TSHR P16473 1/20 0.47

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
SCHEMBL3062252 0.85 MAPT (0.58) HSD17B10TAS2R38NAPRTGAAEPHX1
SCHEMBL8974891 0.81 L3MBTL1 (0.67) HSD17B10NAPRTCYP3A4CYP1A2CYP2C9
SCHEMBL10815608 0.80 NR4A2 (0.55) HSD17B10GAAEPHX1CYP3A4CYP1A2
SCHEMBL1816930 0.79 KMT2A (0.56) HSD17B10TAS2R38GAACYP3A4CYP1A2
SCHEMBL13624828 0.78 CYP3A4 (0.60) HSD17B10TAS2R38GAAEPHX1CYP3A4
SCHEMBL14431137 0.76 HSD17B10 (0.62) HSD17B10TAS2R38GAACYP3A4CYP1A2
SCHEMBL3071122 0.75 HSD17B10 (0.64) HSD17B10TAS2R38GAAEPHX1CYP3A4
SCHEMBL19354045 0.75 MAPT (0.75) GAAMAPTALDH1A1RAB9AKMT2A
SCHEMBL27891875 0.75 ALDH1A1 (0.53) GAACYP2C9MAPTALDH1A1KMT2A
SCHEMBL3071119 0.75 ALDH1A1 (0.58) HSD17B10TAS2R38GAAEPHX1CYP3A4

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-20050004092-A1 Penem derivatives and antimicrobial agent containing the same DAIICHI SUNTORY PHARMA CO., LTD. (JP) 2005-01-06 US disclosed
EP-0757051-B1 PENEM DERIVATIVES AND ANTIMICROBIAL AGENT CONTAINING THE SAME DAIICHI SUNTORY PHARMA CO LTD (JP) 2003-10-29 EP disclosed
EP-0757051-A1 PENEM DERIVATIVES AND ANTIMICROBIAL AGENT CONTAINING THE SAME SUNTORY LIMITED (JP) 1997-02-05 EP 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-20050004092-A1 Penem derivatives and antimicrobial agent containing the same MRPL21, MRPS2, MRPS28 HSD17B10 2661/4885TAS2R38 1408/4885NAPRT 584/4885

“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.