SCHEMBL4757590

SCHEMBL4757590

CON(C)C(=O)c1cc(Cl)cc(C(F)(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.49
GPBAR1 Q8TDU6 9/20 0.46
TACR1 P25103 3/20 0.43
TACR2 P21452 1/20 0.43
NOTUM Q6P988 1/20 0.41
SLC13A3 Q8WWT9 1/20 0.41
CES2 O00748 1/20 0.41
P2RX1 P51575 1/20 0.40
DDR1 Q08345 1/20 0.39
GPR35 Q9HC97 1/20 0.39

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
SCHEMBL3652937 0.89 MLYCD (0.55) MLYCDGPBAR1TACR1NOTUMCES2
SCHEMBL2250431 0.84 TPMT (0.45) MLYCDGPBAR1
SCHEMBL1662271 0.83 MLYCD (0.50) MLYCDGPBAR1TACR1NOTUMCES2
SCHEMBL13715456 0.83 MLYCD (0.50) MLYCDGPBAR1TACR1NOTUMCES2
SCHEMBL12187536 0.83 MLYCD (0.50) MLYCDGPBAR1TACR1NOTUMCES2
SCHEMBL31048071 0.83 MLYCD (0.50) MLYCDGPBAR1TACR1NOTUMCES2
SCHEMBL12563345 0.83 MLYCD (0.50) MLYCDGPBAR1TACR1NOTUMCES2
SCHEMBL14355588 0.82 NOTUM (0.63) MLYCDGPBAR1TACR1NOTUMCES2
SCHEMBL1189827 0.82 MLYCD (0.49) MLYCDGPBAR1TACR1NOTUMCES2
SCHEMBL29918680 0.82 MLYCD (0.49) MLYCDGPBAR1TACR1NOTUMCES2

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
WO-2008133344-A2 PIPERIDINE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-11-06 WO disclosed
US-20080275085-A1 Piperidine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-11-06 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-20080275085-A1 Piperidine derivative and use thereof TACR2, TACR1, PRLHR MLYCD 4131/4885GPBAR1 657/4885TACR1 2/4885

“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.