SCHEMBL19986359

SCHEMBL19986359

CP(=O)(OCCl)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.53
CETP P11597 3/20 0.45
PKM P14618 1/20 0.44
ALDH1A1 P00352 3/20 0.40
FOLH1 Q04609 1/20 0.40
SRC P12931 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
MAOB P27338 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPK1 P28482 1/20 0.38
PDPK1 O15530 1/20 0.38
MTOR P42345 1/20 0.38
ALPG P10696 1/20 0.38
PTK2B Q14289 1/20 0.38
ELANE P08246 1/20 0.38
IDO1 P14902 1/20 0.38

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
SCHEMBL389180 0.90 TSHR (0.63) TSHRCETPPKMALDH1A1FOLH1
SCHEMBL17034260 0.83 TSHR (0.55) TSHRCETPPKMALDH1A1
SCHEMBL8619121 0.81 TSHR (0.57) TSHRCETPPKMALDH1A1FOLH1
SCHEMBL218693 0.81 TSHR (0.57) TSHRCETPALDH1A1FOLH1SRC
SCHEMBL12313535 0.79 TSHR (0.55) TSHRCETPPKMALDH1A1FOLH1
SCHEMBL12746424 0.79 TSHR (0.59) TSHRCETPPKMALDH1A1FOLH1
SCHEMBL3367142 0.78 TSHR (0.63) TSHRCETPPKMALDH1A1FOLH1
SCHEMBL26569501 0.78 TSHR (0.53) TSHRCETPPKMSRCELANE
SCHEMBL4040892 0.78 TSHR (0.81) TSHRCETPALDH1A1FOLH1SRC
SCHEMBL9891064 0.77 TSHR (0.49) TSHRCETPPKMALDH1A1FOLH1

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-11771688-B2 Pyridine derivatives substituted by heterocyclic ring and amino group AMPLYX PHARMACEUTICALS, INC. (US) 2023-10-03 US disclosed
US-20180079753-A1 INHIBITORS OF CELLULAR METABOLIC PROCESSES SERVIER PHARMACEUTICALS LLC 2018-03-22 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 (2 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-20180079753-A1 INHIBITORS OF CELLULAR METABOLIC PROCESSES MNAT1, MAT2A, PCK2 TSHR 2620/4885CETP 3910/4885PKM 1274/4885
US-11771688-B2 Pyridine derivatives substituted by heterocyclic ring and amino group ERG28, PDXK, PAH TSHR 4387/4885CETP 4516/4885PKM 575/4885

“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.