SCHEMBL470957

SCHEMBL470957

Cc1nc2ccc(-c3ccc(C(=O)N4CCOCC4)cc3)cc2s1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 5/20 0.62
▸ LIPC P11150 9/20 0.55
▸ LIPG Q9Y5X9 5/20 0.55
▸ TSHR P16473 2/20 0.55
▸ HTT P42858 1/20 0.55
▸ SCD O00767 1/20 0.54
▸ ALDH1A1 P00352 2/20 0.53
▸ KDM4E B2RXH2 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ HSD17B10 Q99714 1/20 0.51
▸ PIK3CD O00329 1/20 0.49
▸ PIK3R2 O00459 1/20 0.49
▸ PIK3CA P42336 1/20 0.49
▸ PIK3CB P42338 1/20 0.49
▸ PIK3CG P48736 1/20 0.49
▸ PIK3R5 Q8WYR1 1/20 0.49
▸ PIK3R3 Q92569 1/20 0.49

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
SCHEMBL10049918 0.90 HPGD (0.75) HPGDTSHRHTTSCDALDH1A1
SCHEMBL31428937 0.83 HPGD (0.60) HPGDTSHRHTTALDH1A1KDM4E
SCHEMBL19709508 0.81 MEN1 (0.57) HPGDLIPCLIPGTSHRHTT
SCHEMBL14970147 0.79 HPGD (0.81) HPGDTSHRHTTSCDALDH1A1
SCHEMBL12963767 0.78 HPGD (0.79) HPGDTSHRHTTSCDALDH1A1
SCHEMBL3089549 0.76 HPGD (0.65) HPGDTSHRHTTALDH1A1SMN1; SMN2
SCHEMBL15070437 0.75 SMN1; SMN2 (0.78) HPGDTSHRHTTALDH1A1KDM4E
SCHEMBL17194215 0.75 HPGD (0.63) HPGDTSHRHTTALDH1A1KDM4E
SCHEMBL3089547 0.74 HPGD (0.63) HPGDTSHRHTTSCDALDH1A1
SCHEMBL31428953 0.74 HPGD (0.63) HPGDTSHRHTTSCDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2615084-B1 PROSTAGLANDIN D SYNTHASE INHIBITORY PIPERIDINE COMPOUNDS TAIHO PHARMACEUTICAL CO LTD (JP) 2016-01-06 — — EP disclosed
US-9181183-B2 Prostaglandin D synthase inhibitory piperidine compounds TAIHO PHARMACEUTICAL CO., LTD. (JP) 2015-11-10 — — US disclosed
US-9181183-B2 Prostaglandin D synthase inhibitory piperidine compounds TAIHO PHARMACEUTICAL CO., LTD. (JP) 2015-11-10 — — US disclosed
US-20130165438-A1 PROSTAGLANDIN D SYNTHASE INHIBITORY PIPERIDINE COMPOUNDS TAIHO PHARMACEUTICAL CO., LTD. (JP) 2013-06-27 — — US disclosed
US-20130165438-A1 PROSTAGLANDIN D SYNTHASE INHIBITORY PIPERIDINE COMPOUNDS TAIHO PHARMACEUTICAL CO., LTD. (JP) 2013-06-27 — — US disclosed
WO-2012033069-A1 PROSTAGLANDIN D SYNTHASE INHIBITORY PIPERIDINE COMPOUNDS 大鵬薬品工業株式会社 (JP) 2012-03-15 — — WO 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-20130165438-A1 PROSTAGLANDIN D SYNTHASE INHIBITORY PIPERIDINE COMPOUNDS PTGIS, PTGS1, PTGDR HPGD 11/4885LIPC 1659/4885LIPG 1694/4885

“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.

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