SCHEMBL3095865

SCHEMBL3095865

COc1cnc2c(c1)cc(C=CC(=O)O)n2Cc1ccc(Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 3/20 0.43
P2RX3 P56373 6/20 0.42
TBXA2R P21731 2/20 0.40
MAPT P10636 2/20 0.40
LMNA P02545 2/20 0.40
MEN1 O00255 1/20 0.40
RGS12 O14924 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
PKM P14618 1/20 0.40
TSHR P16473 1/20 0.40
NFKB1 P19838 1/20 0.40
MAPK1 P28482 1/20 0.40
CYP2C19 P33261 1/20 0.40
GNAI1 P63096 1/20 0.40
PMP22 Q01453 1/20 0.40
KMT2A Q03164 1/20 0.40
HIF1A Q16665 1/20 0.40

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
SCHEMBL3095854 1.00 CCR2 (0.43) CCR2P2RX3TBXA2RMAPTLMNA
SCHEMBL12966346 0.88 TBXA2R (0.42) P2RX3TBXA2RLMNAMEN1ALDH1A1
SCHEMBL12966284 0.88 P2RX3 (0.46) CCR2P2RX3MAPTLMNAMEN1
SCHEMBL3103070 0.85 ALDH1A1 (0.40) CCR2MAPTLMNAMEN1ALDH1A1
SCHEMBL3090980 0.79 LMNA (0.48) CCR2P2RX3TBXA2RMAPTLMNA
SCHEMBL9959514 0.78 TP53 (0.44) MAPTLMNAALDH1A1CYP1A2CYP3A4
SCHEMBL3088330 0.78 TP53 (0.46) CCR2LMNAALDH1A1CYP1A2CYP3A4
SCHEMBL23630652 0.77 ALOX5AP (0.49) P2RX3TBXA2RMAPTCYP1A2CYP3A4
SCHEMBL3096637 0.77 MAPT (0.52) CCR2P2RX3MAPTLMNAMEN1
SCHEMBL38664699 0.75 CCR2 (0.59) CCR2LMNAALDH1A1CNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1933842-B1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS PANMIRA PHARMACEUTICALS LLC (US) 2012-10-03 EP disclosed
US-7795274-B2 5-lipoxygenase-activating protein (FLAP) inhibitors AMIRA PHARMACEUTICALS INC. (US) 2010-09-14 US disclosed
US-20080227807-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS AMIRA PHARMACEUTICALS, INC. (US) 2008-09-18 US disclosed
US-7405302-B2 5-lipoxygenase-activating protein (FLAP) inhibitors AMIRA PHARMACEUTICALS, INC. (US) 2008-07-29 US disclosed
US-20070123522-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS AMIRA PHARMACEUTICALS, INC. (US) 2007-05-31 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 (2 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-20080227807-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS ALOX5, ALOX15B, ALOX15 CCR2 2928/4885P2RX3 2324/4885TBXA2R 97/4885
US-20070123522-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS ALOX5, ALOX15B, ALOX15 CCR2 2928/4885P2RX3 2324/4885TBXA2R 97/4885

“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.