SCHEMBL2608967

SCHEMBL2608967

CC(C)Cn1cc(Cl)ccc1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.46
TP53 P04637 1/20 0.39
LMNA P02545 1/20 0.38
CNR1 P21554 1/20 0.38
BMPR1B O00238 1/20 0.38
BMPR1A P36894 1/20 0.38
TGFBR1 P36897 1/20 0.38
ACVRL1 P37023 1/20 0.38
ACVR1 Q04771 1/20 0.38
SHMT2 P34897 1/20 0.36
KMT2A Q03164 2/20 0.35
POLB P06746 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
FABP6 P51161 1/20 0.35
ALDH1A1 P00352 3/20 0.34
MEN1 O00255 1/20 0.34

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
SCHEMBL9752608 0.81 MAPT (0.46) MAPTLMNAPOLBSMN1; SMN2FABP6
SCHEMBL9609775 0.78 ALDH1A1 (0.55) MAPTTP53BMPR1BBMPR1ATGFBR1
SCHEMBL15360158 0.78 MAPT (0.50) MAPTLMNAKMT2APOLBSMN1; SMN2
SCHEMBL17229257 0.78 MAPT (0.48) MAPTKMT2APOLBSMN1; SMN2FABP6
SCHEMBL1468537 0.77 NPC1 (0.39) MAPTCNR1BMPR1BBMPR1ATGFBR1
SCHEMBL20197193 0.77 BMPR1B (0.38) MAPTBMPR1BBMPR1ATGFBR1ACVRL1
SCHEMBL15043718 0.74 TP53 (0.37) MAPTTP53LMNABMPR1BBMPR1A
SCHEMBL2609179 0.73 KDM4E (0.47) MAPTTP53LMNAKMT2APOLB
SCHEMBL924099 0.73 B3GNT2 (0.44) MAPTLMNASHMT2KMT2APOLB
SCHEMBL18924402 0.72 ESR1 (0.36) MAPTTP53LMNABMPR1BBMPR1A

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-20120101091-A1 VIRAL POLYMERASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-04-26 US disclosed
US-20120101091-A1 VIRAL POLYMERASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-04-26 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-20120101091-A1 VIRAL POLYMERASE INHIBITORS POLR2A, POLR2H, POLR2E MAPT 4179/4885TP53 1969/4885LMNA 1290/4885

“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.