SCHEMBL14947899

SCHEMBL14947899

Cc1c(F)ccc2c1Cc1[nH]ncc1-2

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 8/20 0.36
CCNA2 P20248 5/20 0.33
CDK2 P24941 5/20 0.33
CCNA1 P78396 5/20 0.33
TGFBR1 P36897 1/20 0.33
AKT2 P31751 2/20 0.33
AKT1 P31749 1/20 0.33
PGR P06401 1/20 0.31
PIK3CA P42336 2/20 0.31
POLB P06746 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL14947904 0.66 PDGFRB (0.31)
SCHEMBL14947900 0.65 PTGS2 (0.30)
SCHEMBL1512753 0.65 USP8 (0.36) KMT2A
SCHEMBL2376041 0.62 MAPK8 (0.56) ROCK2AKT2AKT1POLBKMT2A
SCHEMBL17641728 0.62 MAPT (0.52) TGFBR1KMT2A
SCHEMBL7918824 0.62 IDO1 (0.43) CDK2CCNA1
SCHEMBL18296888 0.61 ACVR1 (0.36) CDK2CCNA1TGFBR1AKT2AKT1
SCHEMBL14947897 0.61 MAPK14 (0.30)
SCHEMBL20231933 0.60 KCNJ1 (0.60)
SCHEMBL23252642 0.60 AHR (0.41) PGR

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-9839623-B2 Tricyclic compounds and methods of making and using same ZAFGEN, INC. (US) 2017-12-12 US disclosed
US-20160354338-A1 TRICYCLIC COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN INC (US) 2016-12-08 US disclosed
US-20130123235-A1 Tricyclic Compounds and Methods of Making and Using Same ZAFGEN, INC. 2013-05-16 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-20130123235-A1 Tricyclic Compounds and Methods of Making and Using Same CES2, DNPEP, METAP2 ROCK2 3174/4885CCNA2 2561/4885CDK2 1822/4885
US-20160354338-A1 TRICYCLIC COMPOUNDS AND METHODS OF MAKING AND USING SAME CES2, DNPEP, METAP2 ROCK2 3174/4885CCNA2 2561/4885CDK2 1822/4885

“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.