SCHEMBL10189967

SCHEMBL10189967

CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Cn2nccn2)CC1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.54
PTPN2 P17706 1/20 0.52
PTPN1 P18031 1/20 0.52
PTPN6 P29350 1/20 0.52
HPGD P15428 1/20 0.49
RECQL P46063 1/20 0.47
STS P08842 8/20 0.46
GPR119 Q8TDV5 2/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
ABL1 P00519 1/20 0.43
RIN1 Q13671 1/20 0.43
EPHX2 P34913 1/20 0.43
ALDH1A1 P00352 1/20 0.42

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
SCHEMBL316688 0.82 KDM4E (0.43) KMT2APTPN1NPC1RAB9AALDH1A1
SCHEMBL16400521 0.80 KMT2A (0.67) KMT2APTPN2PTPN1PTPN6HPGD
SCHEMBL315355 0.80 KMT2A (0.57) KMT2APTPN2PTPN1PTPN6HPGD
SCHEMBL8284357 0.79 KMT2A (0.57) KMT2APTPN2PTPN1PTPN6HPGD
SCHEMBL8284375 0.78 KMT2A (0.55) KMT2APTPN2PTPN1PTPN6HPGD
SCHEMBL12513264 0.76 KMT2A (0.62) KMT2APTPN2PTPN1PTPN6HPGD
SCHEMBL4771557 0.76 BACE1 (0.51) PTPN2PTPN1PTPN6HPGDGPR119
SCHEMBL8549425 0.73 KMT2A (0.58) KMT2APTPN2PTPN1PTPN6HPGD
SCHEMBL12069934 0.73 KMT2A (0.58) KMT2APTPN2PTPN1PTPN6HPGD
SCHEMBL31706334 0.73 KMT2A (0.58) KMT2APTPN2PTPN1PTPN6HPGD

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
US-8093400-B2 Compounds useful in therapy PFIZER INC. (US) 2012-01-10 US disclosed
US-8093400-B2 Compounds useful in therapy PFIZER INC. (US) 2012-01-10 US disclosed
US-20100317652-A1 Compounds Useful In Therapy PFIZER INC 2010-12-16 US disclosed
US-20100317652-A1 Compounds Useful In Therapy PFIZER INC 2010-12-16 US disclosed
US-7745630-B2 Triazolyl piperidine arginine vasopressin receptor modulators BRYANS JUSTIN STEPHEN 2010-06-29 US disclosed
US-7745630-B2 Triazolyl piperidine arginine vasopressin receptor modulators BRYANS JUSTIN STEPHEN 2010-06-29 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-20100317652-A1 Compounds Useful In Therapy AVPR1A, AVPR1B, AVPR2 KMT2A 1134/4885PTPN2 4173/4885PTPN1 3953/4885

“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.