SCHEMBL351997

SCHEMBL351997

O=C(CCN1CCN(c2ccccc2)CC1)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 9/20 0.81
KMT2A Q03164 6/20 0.69
ALDH1A1 P00352 5/20 0.69
MAPT P10636 2/20 0.69
HTR7 P34969 1/20 0.68
GFER P55789 1/20 0.67
THRA P10827 1/20 0.64
THRB P10828 1/20 0.64
MEN1 O00255 1/20 0.63
DRD2 P14416 1/20 0.62
HTR2A P28223 1/20 0.62

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
SCHEMBL11828902 0.91 HTR1A (0.68) HTR1AHTR7DRD2HTR2A
SCHEMBL16026463 0.90 KMT2A (0.83) HTR1AKMT2AALDH1A1MAPTGFER
Hydrochloric Acid SCHEMBL9274815 0.90 HTR1A (0.67) HTR1AKMT2AALDH1A1MAPTHTR7
SCHEMBL11756285 0.89 HTR1A (0.70) HTR1AHTR7DRD2HTR2A
Hydrochloric Acid SCHEMBL7934846 0.88 KMT2A (0.83) HTR1AKMT2AALDH1A1MAPTGFER
SCHEMBL6358223 0.86 HTR1A (1.00) HTR1AKMT2AALDH1A1MAPTTHRA
SCHEMBL2114983 0.85 HTR1A (0.73) HTR1AALDH1A1MAPTHTR7DRD2
SCHEMBL12123756 0.84 HTR1A (0.82) HTR1ATHRATHRB
SCHEMBL11628917 0.84 HTR1A (0.61) HTR1AMAPTHTR7DRD2HTR2A
SCHEMBL351380 0.83 POLB (0.74) HTR1AKMT2AALDH1A1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240287009-A1 AMINE-FUNCTIONAL MONOMERS AND METHODS OF MAKING SAME INFINEUM INTERNATIONAL LIMITED (GB) 2024-08-29 US disclosed
EP-4410772-A2 AMINE-FUNCTIONAL MONOMERS AND METHODS OF MAKING SAME Infineum International Limited (GB) 2024-08-07 EP disclosed
CN-118440229-A Amine functional monomers and methods of making the same 英菲诺姆国际有限公司 2024-08-06 CN disclosed
US-20160060235-A1 Therapeutic Agent for Type 2 Diabetes NATIONAL UNIVERSITY CORPORATION KUMAMOTO UNIVERSITY (JP) 2016-03-03 US disclosed
US-20160060235-A1 Therapeutic Agent for Type 2 Diabetes NATIONAL UNIVERSITY CORPORATION KUMAMOTO UNIVERSITY (JP) 2016-03-03 US disclosed
US-20120016124-A1 SEROTONIN REUPTAKE INHIBITORS BAYLOR UNIVERSITY (US) 2012-01-19 US disclosed
US-7893261-B2 bi-functional organic molecules which combine serotonin transporter reuptake inhibition with serotonin (5-HT, such as 5-HT2A) receptor antagonism in one molecular entity BAYLOR UNIVERSITY (US) 2011-02-22 US disclosed
US-7893261-B2 bi-functional organic molecules which combine serotonin transporter reuptake inhibition with serotonin (5-HT, such as 5-HT2A) receptor antagonism in one molecular entity BAYLOR UNIVERSITY (US) 2011-02-22 US disclosed
US-20080132514-A1 Serotonin Reuptake Inhibitors BAYLOR UNIVERSITY 2008-06-05 US disclosed
US-20080132514-A1 Serotonin Reuptake Inhibitors BAYLOR UNIVERSITY 2008-06-05 US disclosed
EP-1732610-A2 TARGETED SEROTONIN REUPTAKE INHIBITORS BAYLOR UNIVERSITY (US) 2006-12-20 EP disclosed
WO-2005094896-A2 TARGETED SEROTONIN REUPTAKE INHIBITORS BAYLOR UNIVERSITY (US) 2005-10-13 WO disclosed
US-20050176727-A1 Oximes and hydrazones that are useful in treating sexual dysfunction ABBOTT LABORATORIES 2005-08-11 US disclosed
US-4065565-A Acylhydrazones and anti-psychotic compositions thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-12-27 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 (5 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-20120016124-A1 SEROTONIN REUPTAKE INHIBITORS HTR2A, HTR2C, HTR1A HTR1A 3/4885KMT2A 839/4885ALDH1A1 969/4885
US-20240287009-A1 AMINE-FUNCTIONAL MONOMERS AND METHODS OF MAKING SAME AMD1, HNMT, MAT1A HTR1A 857/4885KMT2A 134/4885ALDH1A1 317/4885
US-20050176727-A1 Oximes and hydrazones that are useful in treating sexual dysfunction CYP19A1, SHBG, CYP17A1 HTR1A 871/4885KMT2A 1762/4885ALDH1A1 199/4885
US-20080132514-A1 Serotonin Reuptake Inhibitors HTR2A, HTR2C, HTR1A HTR1A 3/4885KMT2A 839/4885ALDH1A1 969/4885
US-20160060235-A1 Therapeutic Agent for Type 2 Diabetes RNASE1, CDKL2, CDKL1 HTR1A 4839/4885KMT2A 903/4885ALDH1A1 3775/4885

“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.