SCHEMBL5481230

SCHEMBL5481230

Clc1ccccc1C(c1ccccc1)(c1ccccc1)N1Cc2ccccc2C1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 3/20 0.50
KCNA3 P22001 2/20 0.50
KCNH2 Q12809 4/20 0.49
OPRK1 P41145 3/20 0.49
TSHR P16473 3/20 0.49
LMNA P02545 3/20 0.49
HTR2A P28223 2/20 0.49
HTR2C P28335 2/20 0.49
HTT P42858 2/20 0.49
CYP3A4 P08684 2/20 0.49
MAPT P10636 2/20 0.49
ALOX15 P16050 2/20 0.49
RAB9A P51151 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
NR1I2 O75469 2/20 0.49
ADORA3 P0DMS8 2/20 0.49
DRD2 P14416 2/20 0.49
TBXA2R P21731 2/20 0.49
CCKBR P32239 2/20 0.49
DRD3 P35462 2/20 0.49

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
SCHEMBL5280949 0.77 KCNN4 (0.48) KCNN4KCNA3KCNH2OPRK1TSHR
SCHEMBL7769823 0.77 KCNN4 (0.48) KCNN4KCNA3KCNH2OPRK1TSHR
SCHEMBL7777404 0.74 KCNN4 (0.46) KCNN4KCNA3KCNH2OPRK1TSHR
SCHEMBL15587141 0.74 KCNN4 (0.46) KCNN4KCNA3KCNH2OPRK1TSHR
SCHEMBL5479925 0.73 CYP19A1 (0.66) KCNN4KCNA3KCNH2OPRK1TSHR
SCHEMBL3877128 0.70 TRPM5 (0.35) KCNN4KCNA3KCNH2OPRK1TSHR
SCHEMBL11260814 0.70 KCNN4 (0.55) KCNN4KCNA3KCNH2OPRK1TSHR
SCHEMBL5864393 0.70 KCNN4 (0.55) KCNN4KCNA3KCNH2OPRK1TSHR
SCHEMBL30915985 0.69 MAOA (0.48) LMNAMAPTALOX15RAB9ASMN1; SMN2
SCHEMBL12856108 0.68 KCNN4 (0.49) KCNN4KCNA3KCNH2OPRK1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070293554-A1 Non-peptide inhibition of T-lymphocyte activation and therapies related thereto THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 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 (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-20070293554-A1 Non-peptide inhibition of T-lymphocyte activation and therapies related thereto NFATC1, ORAI1, KCNMA1 KCNN4 10/4885KCNA3 46/4885KCNH2 54/4885

“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.