SCHEMBL10272984

SCHEMBL10272984

CN1CCP(=O)(c2ccc(F)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.40
CYP2D6 P10635 1/20 0.40
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
RAB9A P51151 1/20 0.40
ALDH1A1 P00352 2/20 0.39
USP2 O75604 1/20 0.39
HPGD P15428 1/20 0.39
HTT P42858 1/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
MAPT P10636 1/20 0.37
TSHR P16473 1/20 0.36
EPHX2 P34913 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
DRD2 P14416 1/20 0.35
SIGMAR1 Q99720 1/20 0.35

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
SCHEMBL2611683 0.84 HRH3 (0.40) CYP2D6LMNAALDH1A1MAPT
SCHEMBL16908176 0.81 MAPT (0.46) SMN1; SMN2LMNAALDH1A1MAPTL3MBTL1
SCHEMBL2207076 0.81 DRD1 (0.38) ALDH1A1HTR2AMAPTDRD2
SCHEMBL11798652 0.80 HPGD (0.44) SMN1; SMN2CYP2D6HPGDHTR2AHTR2C
SCHEMBL2212046 0.79 NPSR1 (0.45) NPC1TP53RAB9AALDH1A1HPGD
SCHEMBL2209593 0.77 TSHR (0.41) SMN1; SMN2NPC1TP53ALDH1A1USP2
SCHEMBL10269762 0.73 SMN1; SMN2 (0.39) SMN1; SMN2CYP2D6NPC1LMNATP53
SCHEMBL894517 0.72 SIGMAR1 (0.50) HTTSIGMAR1
Hydrochloric Acid SCHEMBL894109 0.71 HTR7 (0.34) ALDH1A1HTR2AHTR2C
SCHEMBL29221145 0.69 HPGD (0.42) CYP2D6HPGDHTR2AHTR2CL3MBTL1

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-20120108547-A1 INHIBITORS OF TYROSINE KINASES AND USES THEREOF PHARMACYCLICS, INC. (US) 2012-05-03 US disclosed
US-8067395-B2 Inhibitors of tyrosine kinases and uses thereof PHARMACYCLICS, INC. (US) 2011-11-29 US disclosed
US-20100035841-A1 INHIBITORS OF TYROSINE KINASES AND USES THEREOF PHARMACYCLICS, INC. (US) 2010-02-11 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-20120108547-A1 INHIBITORS OF TYROSINE KINASES AND USES THEREOF LCK, ABL1, SRC SMN1; SMN2 1914/4885CYP2D6 3066/4885NPC1 3413/4885
US-20100035841-A1 INHIBITORS OF TYROSINE KINASES AND USES THEREOF LCK, ABL1, SRC SMN1; SMN2 1914/4885CYP2D6 3066/4885NPC1 3413/4885

“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.