SCHEMBL4134830

SCHEMBL4134830

NC(=O)C1(C(=O)O)CC1c1ccc(F)cc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 6/20 0.41
RCOR1 Q9UKL0 4/20 0.41
LIG1 P18858 1/20 0.41
SLC9A1 P19634 1/20 0.39
PTGS2 P35354 1/20 0.38
HSD11B1 P28845 1/20 0.37
ALDH1A1 P00352 2/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
KCNH2 Q12809 1/20 0.35
KCNN4 O15554 1/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34

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
SCHEMBL900614 0.91 KDM1A (0.45) KDM1ARCOR1LIG1SLC9A1PTGS2
Water SCHEMBL2458176 0.90 KDM1A (0.44) KDM1ARCOR1LIG1SLC9A1PTGS2
Hydrochloric Acid SCHEMBL29430083 0.90 KDM1A (0.47) KDM1ARCOR1LIG1SLC9A1PTGS2
SCHEMBL2401865 0.84 KDM1A (0.46) KDM1AMAOAMAOB
SCHEMBL4133969 0.83 KDM1A (0.44) KDM1ARCOR1LIG1KCNH2MAOA
SCHEMBL5683641 0.81 OPRK1 (0.43) KDM1ARCOR1LIG1SLC9A1KMT2A
SCHEMBL29453536 0.81 KDM1A (0.41) KDM1ARCOR1LIG1SLC9A1PTGS2
SCHEMBL4134001 0.81 KDM1A (0.47) KDM1ARCOR1KCNN4
SCHEMBL8905787 0.81 F2 (0.40)
Hydrochloric Acid SCHEMBL8904395 0.80 BLM (0.39) KMT2A

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-20090203750-A1 5-HT2C Receptor Agonists as Anorectic Agents NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2009-08-13 US disclosed
WO-2007025144-A1 5-HT2C RECEPTOR AGONISTS AS ANORECTIC AGENTS UNIVERSITY OF ILLINOIS - CHICAGO (US) 2007-03-01 WO 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-20090203750-A1 5-HT2C Receptor Agonists as Anorectic Agents HTR2C, HTR2A, HTR5A KDM1A 3105/4885RCOR1 2462/4885LIG1 4800/4885

“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.