SCHEMBL4832980

SCHEMBL4832980

COC(=O)CCCc1ccc(CN)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 2/20 0.53
▸ EPHX2 P34913 1/20 0.51
▸ TSHR P16473 1/20 0.48
▸ CYP4A11 Q02928 3/20 0.47
▸ CYP4F2 P78329 2/20 0.47
▸ TPSAB1 Q15661 2/20 0.46
▸ ALOX5 P09917 1/20 0.45
▸ CYP4Z1 Q86W10 1/20 0.43
▸ CYP4F11 Q9HBI6 1/20 0.43
▸ CYP4F12 Q9HCS2 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43

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
Hydrochloric Acid SCHEMBL4832972 0.98 LOXL2 (0.51) LOXL2EPHX2TSHRCYP4A11CYP4F2
SCHEMBL22921868 0.91 TSHR (0.58) EPHX2TSHRCYP4A11CYP4F2ALOX5
SCHEMBL2851609 0.89 LOXL2 (0.56) LOXL2EPHX2TSHRCYP4A11CYP4F2
Hydrochloric Acid SCHEMBL10869249 0.88 TAAR1 (0.47) EPHX2TSHRCYP4A11CYP4F2ALOX5
Hydrochloric Acid SCHEMBL926987 0.87 LOXL2 (0.55) LOXL2EPHX2CYP4A11CYP4F2TPSAB1
SCHEMBL4841796 0.87 LOXL2 (0.54) LOXL2TSHRCYP4A11CYP4F2ALDH1A1
SCHEMBL11139007 0.86 EPHX2 (0.46) EPHX2TSHRCYP4A11CYP4F2ALOX5
SCHEMBL1351101 0.86 TSHR (0.48) EPHX2TSHRCYP4A11CYP4F2ALOX5
Hydrochloric Acid SCHEMBL4841789 0.85 LOXL2 (0.53) LOXL2TSHRCYP4A11CYP4F2ALDH1A1
SCHEMBL11135506 0.84 LOXL2 (0.51) LOXL2EPHX2CYP4A11CYP4F2TPSAB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7465811-B2 Indoline compounds LABORATOIRES FOURNIER S.A. (FR) 2008-12-16 — — US disclosed
US-20080119465-A1 Novel Indoline Compounds LABORATORIES FOURNIER S.A. (FR) 2008-05-22 — — 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-20080119465-A1 Novel Indoline Compounds GPR119, INSR, IRS1 LOXL2 4346/4885EPHX2 3674/4885TSHR 681/4885

“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.

Send feedback