SCHEMBL2350243

SCHEMBL2350243

Cc1[c]cnn1-c1ccccc1F

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 9/20 0.41
HCAR1 Q9BXC0 1/20 0.40
KMT2A Q03164 3/20 0.39
HPGD P15428 1/20 0.39
MEN1 O00255 2/20 0.39
MGLL Q99685 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
PRNP P04156 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
SCN9A Q15858 2/20 0.37
SCN10A Q9Y5Y9 1/20 0.37

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
SCHEMBL2897551 0.81 ALDH1A1 (0.42) KMT2AHPGDMEN1MGLLSMN1; SMN2
SCHEMBL2900034 0.79 NPC1 (0.44) SMN1; SMN2
SCHEMBL2903061 0.79 HCAR1 (0.42) KCNN4HCAR1MGLL
SCHEMBL1903586 0.79 MAPK14 (0.40) KCNN4HCAR1KMT2AMEN1MGLL
SCHEMBL316519 0.73 RAB9A (0.41) KMT2ASMN1; SMN2RXFP1
SCHEMBL1906253 0.70 ALDH1A1 (0.40) KMT2AHPGDMEN1MGLLSMN1; SMN2
SCHEMBL1902421 0.69 FAAH (0.42) KMT2AMEN1MGLLSMN1; SMN2RXFP1
SCHEMBL2900762 0.68 HCAR1 (0.41) HCAR1MGLLSCN9A
SCHEMBL1906555 0.68 ALDH1A1 (0.38) HCAR1KMT2AMEN1
SCHEMBL17144796 0.67 MAPK14 (0.48) KCNN4KMT2AHPGDMEN1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8455477-B2 Therapeutic compounds MERCK SHARP & DOHME CORP. (US) 2013-06-04 US disclosed
US-20110207711-A1 Therapeutic Compounds MSD K.K. (JP) 2011-08-25 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-20110207711-A1 Therapeutic Compounds WEE2, MARK3, WEE1 KCNN4 4505/4885HCAR1 2490/4885KMT2A 2181/4885

“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.