SCHEMBL2352229

SCHEMBL2352229

CC1=C(Cc2ccccc2)C1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.52
TAAR1 Q96RJ0 2/20 0.42
TP53 P04637 1/20 0.42
TRPA1 O75762 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
LTA4H P09960 1/20 0.41
KDM4E B2RXH2 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
ATM Q13315 1/20 0.39
LMNA P02545 2/20 0.39
MC4R P32245 1/20 0.39
SORT1 Q99523 1/20 0.38
BCL2 P10415 1/20 0.38
BCL2L1 Q07817 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL9566501 0.76 CALM1 (0.61) CALM1TAAR1TP53TRPA1ALDH1A1
SCHEMBL2031509 0.75 CALM1 (0.52) CALM1TAAR1TP53TRPA1ALDH1A1
SCHEMBL8198124 0.75 CALM1 (0.52) CALM1TAAR1TP53TRPA1ALDH1A1
SCHEMBL2353774 0.75 CALM1 (0.52) CALM1TAAR1TP53TRPA1ALDH1A1
SCHEMBL2353037 0.75 CALM1 (0.52) CALM1TAAR1ALDH1A1TSHRLTA4H
SCHEMBL8007700 0.74 TAAR1 (0.50) TAAR1ALDH1A1
SCHEMBL8067807 0.72 HTR2C (0.43) TAAR1TSHRLMNA
Diphenylmethane SCHEMBL27450549 0.72 CALM1 (0.86) CALM1TAAR1TP53TRPA1ALDH1A1
SCHEMBL8087981 0.72 CALM1 (0.42) CALM1TAAR1TP53TSHRLTA4H
Diphenylmethane SCHEMBL14763944 0.71 CALM1 (1.00) CALM1TP53TRPA1ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110190137-A1 METHOD TO INHIBIT ETHYLENE RESPONSES IN PLANTS JACOBSON RICHARD MARTIN 2011-08-04 US disclosed
EP-1409440-A4 A METHOD TO INHIBIT ETHYLENE RESPONSES IN PLANTS ROHM & HAAS (US) 2005-09-14 EP disclosed
US-20050065033-A1 Method to inhibit ethylene responses in plants JACOBSON RICHARD MARTIN (US) 2005-03-24 US disclosed
EP-1409440-A1 A METHOD TO INHIBIT ETHYLENE RESPONSES IN PLANTS ROHM AND HAAS COMPANY (US) 2004-04-21 EP disclosed
EP-1236397-B1 Delivery systems for cyclopropenes ROHM & HAAS (US) 2004-02-04 EP disclosed
US-6548448-B2 Delivery systems for cyclopropenes ROHM AND HAAS COMPANY 2003-04-15 US disclosed
US-20020198107-A1 Delivery systems for cyclopropenes AGROFRESH, INC. 2002-12-26 US disclosed
WO-2002068367-A1 A METHOD TO INHIBIT ETHYLENE RESPONSES IN PLANTS ROHM AND HAAS COMPANY (US) 2002-09-06 WO disclosed
EP-1236397-A2 Delivery systems for cyclopropenes ROHM AND HAAS COMPANY (US) 2002-09-04 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 (3 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-20050065033-A1 Method to inhibit ethylene responses in plants ERN1, CTH, CBS CALM1 2295/4885TAAR1 2695/4885TP53 4536/4885
US-20110190137-A1 METHOD TO INHIBIT ETHYLENE RESPONSES IN PLANTS ERN1, CTH, CBR3 CALM1 2209/4885TAAR1 2602/4885TP53 4585/4885
US-20020198107-A1 Delivery systems for cyclopropenes FKBP2, FKBP4, FKBP1A CALM1 595/4885TAAR1 2556/4885TP53 2576/4885

“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.