SCHEMBL719558

SCHEMBL719558

CS(=O)(=O)N1CCN(C(=O)CCCCl)CC1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
ATM Q13315 2/20 0.56
POLB P06746 2/20 0.54
TSHR P16473 1/20 0.49
MAPK1 P28482 1/20 0.48
TDP1 Q9NUW8 2/20 0.46
HTT P42858 1/20 0.44
L3MBTL1 Q9Y468 5/20 0.41
APOBEC3A P31941 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
NPC1 O15118 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL17447522 0.84 TDP1 (0.59) ALDH1A1ATMPOLBTSHRMAPK1
SCHEMBL10077098 0.83 ALDH1A1 (0.56) ALDH1A1ATMPOLBTSHRMAPK1
SCHEMBL10052779 0.83 ALDH1A1 (0.56) ALDH1A1ATMPOLBTSHRMAPK1
SCHEMBL19177078 0.83 L3MBTL1 (0.62) ALDH1A1ATMPOLBTSHRTDP1
SCHEMBL19651894 0.82 ALDH1A1 (0.54) ALDH1A1ATMPOLBTSHRMAPK1
Hydrochloric Acid SCHEMBL721903 0.81 ALDH1A1 (0.55) ALDH1A1ATMPOLBTSHRMAPK1
SCHEMBL20458835 0.80 ALDH1A1 (0.61) ALDH1A1ATMPOLBTSHRMAPK1
SCHEMBL19169789 0.80 ALDH1A1 (0.57) ALDH1A1ATMPOLBTSHRMAPK1
SCHEMBL10972319 0.78 KMT2A (0.51) ALDH1A1ATMTDP1HTTL3MBTL1
SCHEMBL4497375 0.78 ATM (0.48) ALDH1A1ATMPOLBTDP1HTT

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-20120053180-A1 CYCLOHEXANE ANALOGUES AS GPR119 AGONISTS CHEMIZON, A DIVISION OF OPTOMAGIC CO., LTD. (KR) 2012-03-01 US disclosed
US-20120053180-A1 CYCLOHEXANE ANALOGUES AS GPR119 AGONISTS CHEMIZON, A DIVISION OF OPTOMAGIC CO., LTD. (KR) 2012-03-01 US disclosed
US-20120053180-A1 CYCLOHEXANE ANALOGUES AS GPR119 AGONISTS CHEMIZON, A DIVISION OF OPTOMAGIC CO., LTD. (KR) 2012-03-01 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-20120053180-A1 CYCLOHEXANE ANALOGUES AS GPR119 AGONISTS GPR119, GLP1R, GIPR ALDH1A1 1093/4885ATM 4836/4885POLB 4720/4885

“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.