SCHEMBL16244643

SCHEMBL16244643

Cc1nnc2c(NC(=O)O)cc(Cl)nn12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD9 Q9H8M2 2/20 0.50
BRPF1 P55201 2/20 0.42
BRD4 O60885 13/20 0.41
CREBBP Q92793 2/20 0.41
CECR2 Q9BXF3 2/20 0.41
TRIM24 O15164 1/20 0.41
BRD1 O95696 1/20 0.41
TAF1 P21675 1/20 0.41
BRD2 P25440 1/20 0.41
SMARCA4 P51532 1/20 0.41
BPTF Q12830 1/20 0.41
BRDT Q58F21 1/20 0.41
ATAD2 Q6PL18 1/20 0.41
PBRM1 Q86U86 1/20 0.41
TAF1L Q8IZX4 1/20 0.41
KAT2B Q92831 1/20 0.41
BRD7 Q9NPI1 1/20 0.41
BAZ2A Q9UIF9 1/20 0.41
BRPF3 Q9ULD4 1/20 0.41
RXFP1 Q9HBX9 1/20 0.39

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
SCHEMBL16259909 0.84 BRD9 (0.68) BRD9BRPF1BRD4CREBBPCECR2
SCHEMBL15711581 0.81 BRD4 (0.49) BRD9BRPF1BRD4CREBBPCECR2
SCHEMBL14246825 0.78 L3MBTL1 (0.41) BRD9BRD4RXFP1L3MBTL1TDP1
SCHEMBL15711583 0.77 BRD4 (0.49) BRD9BRD4KAT2BRXFP1L3MBTL1
SCHEMBL20160275 0.77 RXFP1 (0.40) BRD9BRPF1BRD4CREBBPCECR2
SCHEMBL6620694 0.74 RXFP1 (0.42) BRD9BRPF1BRD4CREBBPCECR2
SCHEMBL20160027 0.74 L3MBTL1 (0.40) BRD9BRD4CREBBPCECR2BRD2
SCHEMBL16259900 0.74 ALDH1A1 (0.46) BRD9BRPF1BRD4CREBBPCECR2
SCHEMBL16244397 0.74 RXFP1 (0.37) BRD9BRD4CREBBPCECR2KAT2B
SCHEMBL31201620 0.73 BRD4 (0.49) BRD9BRD4KAT2BRXFP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3004110-B1 PYRAZOLOPYRROLIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE NOVARTIS AG (CH) 2017-07-26 EP disclosed
EP-3004110-A1 PYRAZOLOPYRROLIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE Novartis AG (CH) 2016-04-13 EP disclosed
US-20160095843-A1 PYRAZOLOPYRROLIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE NOVARTIS AG (CH) 2016-04-07 US disclosed
US-8975417-B2 Pyrazolopyrrolidine derivatives and their use in the treatment of disease NOVARTIS AG (CH) 2015-03-10 US disclosed
WO-2014191896-A1 PYRAZOLOPYRROLIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE NOVARTIS AG (CH) 2014-12-04 WO disclosed
US-20140349990-A1 Pyrazolopyrrolidine Derivatives and their Use in the Treatment of Disease NOVARTIS AG (CH) 2014-11-27 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-20160095843-A1 PYRAZOLOPYRROLIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE PKD1, PKD2, REN BRD9 996/4885BRPF1 1675/4885BRD4 609/4885
US-20140349990-A1 Pyrazolopyrrolidine Derivatives and their Use in the Treatment of Disease PKD1, PKD2, REN BRD9 1003/4885BRPF1 1662/4885BRD4 652/4885

“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.