SCHEMBL2882609

SCHEMBL2882609

Cc1ccccc1C1CCN(C(=O)O)CC1F

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.41
TRPV1 Q8NER1 1/20 0.41
BRD4 O60885 2/20 0.40
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
HTR2B P41595 1/20 0.39
MAPK14 Q16539 1/20 0.39
ALDH1A1 P00352 1/20 0.38
RBP4 P02753 1/20 0.37
AVPR1A P37288 1/20 0.37
AR P10275 2/20 0.37
ACHE P22303 1/20 0.37
TACR1 P25103 1/20 0.37
TSHR P16473 1/20 0.36
KMT2A Q03164 1/20 0.36
PROKR1 Q8TCW9 2/20 0.36
HDAC4 P56524 1/20 0.36

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
SCHEMBL2882613 1.00 HSD11B1 (0.41) HSD11B1TRPV1BRD4CYP2C9CYP2C19
SCHEMBL2882780 1.00 HSD11B1 (0.41) HSD11B1TRPV1BRD4CYP2C9CYP2C19
SCHEMBL2883527 0.84 OPRL1 (0.43) HSD11B1TRPV1BRD4CYP2C9CYP2C19
SCHEMBL2882238 0.84 OPRL1 (0.43) HSD11B1TRPV1BRD4CYP2C9CYP2C19
SCHEMBL2883668 0.81 HSD11B1 (0.40) HSD11B1TRPV1BRD4CYP2C9CYP2C19
SCHEMBL27766021 0.77 GPR119 (0.42) HSD11B1TRPV1TACR1KMT2A
SCHEMBL27900121 0.76 TRPV1 (0.55) HSD11B1TRPV1BRD4CYP2C9CYP2C19
SCHEMBL25335842 0.74 ADRB2 (0.39) HSD11B1ALDH1A1
SCHEMBL25339124 0.74 ADRB2 (0.39) HSD11B1ALDH1A1
SCHEMBL16874611 0.72 KCNH2 (0.44)

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-7855294-B2 Cycloalkanopyridine derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-12-21 US disclosed
US-20070191419-A1 Cycloalkanopyridine derivative MSD K.K. (JP) 2007-08-16 US disclosed
EP-1726590-A1 CYCLOALKANOPYRIDINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-11-29 EP 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-20070191419-A1 Cycloalkanopyridine derivative OPRL1, OPRK1, AVPR2 HSD11B1 1480/4885TRPV1 126/4885BRD4 4074/4885

“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.