SCHEMBL15907988

SCHEMBL15907988

O=C(CCN1C(=O)C=CC1=O)NCCCOCCC(=O)ON1C(=O)CCC1=O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ HPGD P15428 2/20 0.40
▸ TSHR P16473 2/20 0.40
▸ HTT P42858 1/20 0.40
▸ MGLL Q99685 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ PTGS1 P23219 1/20 0.32
▸ PTGS2 P35354 1/20 0.32

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
SCHEMBL26032503 0.96 HSD17B10 (0.41) POLBHSD17B10SMN1; SMN2HPGDTSHR
SCHEMBL12092085 0.93 HPGD (0.41) POLBHSD17B10SMN1; SMN2HPGDTSHR
SCHEMBL15697251 0.93 POLB (0.38) POLBHSD17B10SMN1; SMN2HPGDTSHR
SCHEMBL13642705 0.93 POLB (0.38) POLBHSD17B10SMN1; SMN2HPGDTSHR
SCHEMBL14701700 0.92 HPGD (0.40) POLBHSD17B10SMN1; SMN2HPGDTSHR
SCHEMBL15017077 0.92 HPGD (0.40) POLBHSD17B10SMN1; SMN2HPGDTSHR
SCHEMBL16245112 0.92 HPGD (0.40) POLBHSD17B10SMN1; SMN2HPGDTSHR
SCHEMBL526532 0.92 HPGD (0.40) POLBHSD17B10SMN1; SMN2HPGDTSHR
SCHEMBL20254025 0.92 HPGD (0.40) POLBHSD17B10SMN1; SMN2HPGDTSHR
SCHEMBL15152064 0.92 HPGD (0.40) POLBHSD17B10SMN1; SMN2HPGDTSHR

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-10435509-B2 Hetero type monodispersed polyethylene glycol, intermediate for production of hetero type monodispersed polyethylene glycol, methods for producing same, and hetero type monodispersed polyethylene glycol conjugate TOHOKU TECHNO ARCH CO., LTD. (JP) 2019-10-08 — — US disclosed
US-9394354-B2 Haptens of paliperidone JANSSEN PHARMACEUTICA NV (BE) 2016-07-19 — — US disclosed
US-20140213767-A1 HAPTENS OF PALIPERIDONE ORTHO-CLINICAL DIAGNOSTICS, INC. (US) 2014-07-31 — — 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-20140213767-A1 HAPTENS OF PALIPERIDONE CD274, PIN1, LY96 POLB 4241/4885HSD17B10 2566/4885SMN1; SMN2 3323/4885

“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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