SCHEMBL12123733

SCHEMBL12123733

CC(=O)CCN1CCC(C(c2ccccc2)c2ccccc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRCP P42785 3/20 0.55
CARM1 Q86X55 1/20 0.49
PRMT6 Q96LA8 1/20 0.49
CHRM2 P08172 1/20 0.48
HTR1A P08908 1/20 0.48
CHRM1 P11229 1/20 0.48
DRD2 P14416 1/20 0.48
ADRA1D P25100 1/20 0.48
ADRA1A P35348 1/20 0.48
ADRA1B P35368 1/20 0.48
BACE1 P56817 2/20 0.48
KDM4E B2RXH2 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
TSHR P16473 1/20 0.48
HTR2A P28223 1/20 0.48
HTR2C P28335 1/20 0.48
CCR5 P51681 1/20 0.47

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
SCHEMBL14282941 0.88 PRCP (0.54) PRCPCARM1PRMT6BACE1KDM4E
SCHEMBL4253158 0.85 PRCP (0.55) PRCPCARM1PRMT6BACE1KDM4E
SCHEMBL4695183 0.85 PRCP (0.52) PRCPCARM1PRMT6CHRM2HTR1A
SCHEMBL14282940 0.84 ALDH1A1 (0.52) PRCPKDM4E
SCHEMBL4072745 0.82 PRCP (0.49) PRCPCARM1PRMT6BACE1KDM4E
SCHEMBL14198387 0.82 DRD2 (0.60) CARM1PRMT6DRD2BACE1KDM4E
SCHEMBL7280203 0.81 SLC18A3 (0.51) PRCPCARM1PRMT6BACE1CYP1A2
SCHEMBL7280401 0.80 SLC18A3 (0.58) CARM1PRMT6BACE1KDM4ECYP1A2
SCHEMBL14198372 0.80 CHRM2 (0.61) CHRM2HTR1ACHRM1DRD2ADRA1D
SCHEMBL3662230 0.79 BACE1 (0.58) BACE1KDM4ECYP1A2CYP3A4CYP2D6

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-20150290200-A1 INTRACELLULAR KINASE INHIBITORS PHARMACYCLICS INC (US) 2015-10-15 US disclosed
US-20140080833-A1 INTRACELLULAR KINASE INHIBITORS MANNKIND CORPORATION (US) 2014-03-20 US disclosed
US-20110281850-A1 INTRACELLULAR KINASE INHIBITORS MANNKIND CORPORATION (US) 2011-11-17 US disclosed
US-7355042-B2 Treatment of CNS disorders using CNS target modulators HYPNION, INC. (US) 2008-04-08 US disclosed
US-7317026-B2 Sleep disorders; side effect reduction ; antihistamine antagonist HYPNION, INC. (US) 2008-01-08 US disclosed
US-20070293499-A1 Intracellular Kinase Inhibitors MANNKIND CORPORATION (US) 2007-12-20 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 (4 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-20070293499-A1 Intracellular Kinase Inhibitors PI4KB, BTK, LTK PRCP 2455/4885CARM1 1686/4885PRMT6 1399/4885
US-20150290200-A1 INTRACELLULAR KINASE INHIBITORS PI4KB, BTK, LTK PRCP 2455/4885CARM1 1686/4885PRMT6 1399/4885
US-20110281850-A1 INTRACELLULAR KINASE INHIBITORS PI4KB, BTK, LTK PRCP 2455/4885CARM1 1686/4885PRMT6 1399/4885
US-20140080833-A1 INTRACELLULAR KINASE INHIBITORS PI4KB, BTK, LTK PRCP 2455/4885CARM1 1686/4885PRMT6 1399/4885

“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.