SCHEMBL10189974

SCHEMBL10189974

Cc1nnc(C2CCN(C(=O)c3ccccc3)CC2)n1-c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 6/20 0.57
ACHE P22303 1/20 0.52
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
HTR2B P41595 1/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
LMNA P02545 1/20 0.46
KDM4E B2RXH2 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
EPHX1 P07099 1/20 0.46
L3MBTL3 Q96JM7 1/20 0.46
ALDH1A1 P00352 1/20 0.45
ALOX15 P16050 1/20 0.45
HTT P42858 1/20 0.45
HSD17B10 Q99714 1/20 0.45
MGLL Q99685 1/20 0.45

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
SCHEMBL22404799 0.81 AVPR1A (0.66) AVPR1AKMT2AMEN1L3MBTL1LMNA
SCHEMBL11086116 0.72 AVPR1A (0.57) AVPR1AACHEKMT2AMEN1ALDH1A1
SCHEMBL4206605 0.72 CA12 (0.71) ACHEKMT2AMEN1L3MBTL1KDM4E
SCHEMBL21084408 0.72 LMNA (0.67) ACHEKMT2AMEN1L3MBTL1LMNA
SCHEMBL13408189 0.72 KMT2A (0.68) ACHEKMT2AMEN1L3MBTL1LMNA
SCHEMBL436168 0.70 ACHE (1.00) ACHEKMT2AMEN1L3MBTL1KDM4E
SCHEMBL10189899 0.70 MEN1 (0.56) AVPR1AKMT2AMEN1LMNASMN1; SMN2
SCHEMBL315110 0.70 LMNA (0.64) KMT2AMEN1LMNAKDM4EALDH1A1
SCHEMBL4003983 0.70 ACHE (0.73) ACHEKMT2AMEN1L3MBTL1KDM4E
SCHEMBL12362806 0.69 AVPR1A (0.50) AVPR1AKMT2AMEN1L3MBTL1LMNA

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-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-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 AVPR1A 1/4885ACHE 1406/4885KMT2A 1134/4885

“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.